AY07024
2177266-76-9 | ethyl 5-((tert-butoxycarbonyl)amino)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxylate
Manufacturer: A2B Chem
CAS Number: 2177266-76-9
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Catalog Number
AY07024
Chemical Name
ethyl 5-((tert-butoxycarbonyl)amino)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxylate
Cas Number
2177266-76-9
Molecular Formula
C15H22N2O5
Molecular Weight
310.3456
Mdl Number
MFCD31731586
Smiles
CCOC(=O)c1noc2c1CC(CC2)NC(=O)OC(C)(C)C
Complexity
421
Covalently-Bonded Unit Count
1
Heavy Atom Count
22
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
1
Rotatable Bond Count
6
Undefined Atom Stereocenter Count
1
Xlogp3
2.4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | Ethyl 5-((tert-butoxycarbonyl)amino)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxylate | ChemScene | ₹ 1,34,123.00 |
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Catalog Number: AY07024
Chemical Name: ethyl 5-((tert-butoxycarbonyl)amino)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxylate
Cas Number: 2177266-76-9
Molecular Formula: C15H22N2O5
Molecular Weight: 310.3456
Mdl Number: MFCD31731586
Smiles: CCOC(=O)c1noc2c1CC(CC2)NC(=O)OC(C)(C)C
Complexity: 421
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 22
Hydrogen Bond Acceptor Count: 6
Hydrogen Bond Donor Count: 1
Rotatable Bond Count: 6
Undefined Atom Stereocenter Count: 1
Xlogp3: 2.4
Catalog Number:
AY07024
Chemical Name:
ethyl 5-((tert-butoxycarbonyl)amino)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxylate
Cas Number:
2177266-76-9
Molecular Formula:
C15H22N2O5
Molecular Weight:
310.3456
Mdl Number:
MFCD31731586
Smiles:
CCOC(=O)c1noc2c1CC(CC2)NC(=O)OC(C)(C)C
Complexity:
421
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Rotatable Bond Count:
6
Undefined Atom Stereocenter Count:
1
Xlogp3:
2.4
Catalog Number: AY07025
Chemical Name: 4-amino-6-bromo-2-chloro-7-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
Cas Number: 2177263-53-3
Molecular Formula: C8H5BrClN5
Molecular Weight: 286.5158
Mdl Number: MFCD31652566
Smiles: N#Cc1c(Br)n(c2c1c(N)nc(n2)Cl)C
Complexity: 305
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 15
Hydrogen Bond Acceptor Count: 4
Hydrogen Bond Donor Count: 1
Rotatable Bond Count: __
Undefined Atom Stereocenter Count: __
Xlogp3: 2
Catalog Number:
AY07025
Chemical Name:
4-amino-6-bromo-2-chloro-7-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
Cas Number:
2177263-53-3
Molecular Formula:
C8H5BrClN5
Molecular Weight:
286.5158
Mdl Number:
MFCD31652566
Smiles:
N#Cc1c(Br)n(c2c1c(N)nc(n2)Cl)C
Complexity:
305
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
2
Catalog Number: AY07026
Chemical Name: tert-butyl 2-imino-4,6,7,8-tetrahydro-1H-pyrazolo[1,5-a][1,4]diazepine-5(2H)-carboxylate hydrochloride
Cas Number: 2177263-54-4
Molecular Formula: C12H21ClN4O2
Molecular Weight: 288.7737
Mdl Number: MFCD28992125
Smiles: O=C(N1CCCn2c(C1)cc(=N)[nH]2)OC(C)(C)C.Cl
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Undefined Atom Stereocenter Count: __
Xlogp3: __
Catalog Number:
AY07026
Chemical Name:
tert-butyl 2-imino-4,6,7,8-tetrahydro-1H-pyrazolo[1,5-a][1,4]diazepine-5(2H)-carboxylate hydrochloride
Cas Number:
2177263-54-4
Molecular Formula:
C12H21ClN4O2
Molecular Weight:
288.7737
Mdl Number:
MFCD28992125
Smiles:
O=C(N1CCCn2c(C1)cc(=N)[nH]2)OC(C)(C)C.Cl
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
__
Catalog Number: AY07027
Chemical Name: 5-bromo-3-methyl-1-(tetrahydro-2H-pyran-2-yl)-1H-pyrazolo[3,4-b]pyridine
Cas Number: 2177258-36-3
Molecular Formula: C12H14BrN3O
Molecular Weight: 296.1631
Mdl Number: MFCD31652280
Smiles: Brc1cnc2c(c1)c(C)nn2C1CCCCO1
Complexity: 279
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 17
Hydrogen Bond Acceptor Count: 3
Hydrogen Bond Donor Count: __
Rotatable Bond Count: 1
Undefined Atom Stereocenter Count: 1
Xlogp3: 2.7
Catalog Number:
AY07027
Chemical Name:
5-bromo-3-methyl-1-(tetrahydro-2H-pyran-2-yl)-1H-pyrazolo[3,4-b]pyridine
Cas Number:
2177258-36-3
Molecular Formula:
C12H14BrN3O
Molecular Weight:
296.1631
Mdl Number:
MFCD31652280
Smiles:
Brc1cnc2c(c1)c(C)nn2C1CCCCO1
Complexity:
279
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
1
Undefined Atom Stereocenter Count:
1
Xlogp3:
2.7