AX06817
307976-20-1 | Ethyl 1-benzyl-4-(1-((tert-butoxycarbonyl)amino)cyclopropyl)pyrrolidine-3-carboxylate
Manufacturer: A2B Chem
CAS Number: 307976-20-1
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Catalog Number
AX06817
Chemical Name
Ethyl 1-benzyl-4-(1-((tert-butoxycarbonyl)amino)cyclopropyl)pyrrolidine-3-carboxylate
Cas Number
307976-20-1
Molecular Formula
C22H32N2O4
Molecular Weight
388.5005
Mdl Number
MFCD13191515
Smiles
CCOC(=O)C1CN(CC1C1(CC1)NC(=O)OC(C)(C)C)Cc1ccccc1
Complexity
561
Covalently-Bonded Unit Count
1
Heavy Atom Count
28
Hydrogen Bond Acceptor Count
5
Hydrogen Bond Donor Count
1
Rotatable Bond Count
9
Undefined Atom Stereocenter Count
2
Xlogp3
3.1
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|---|---|---|---|---|
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Catalog Number: AX06817
Chemical Name: Ethyl 1-benzyl-4-(1-((tert-butoxycarbonyl)amino)cyclopropyl)pyrrolidine-3-carboxylate
Cas Number: 307976-20-1
Molecular Formula: C22H32N2O4
Molecular Weight: 388.5005
Mdl Number: MFCD13191515
Smiles: CCOC(=O)C1CN(CC1C1(CC1)NC(=O)OC(C)(C)C)Cc1ccccc1
Complexity: 561
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 28
Hydrogen Bond Acceptor Count: 5
Hydrogen Bond Donor Count: 1
Rotatable Bond Count: 9
Undefined Atom Stereocenter Count: 2
Xlogp3: 3.1
Catalog Number:
AX06817
Chemical Name:
Ethyl 1-benzyl-4-(1-((tert-butoxycarbonyl)amino)cyclopropyl)pyrrolidine-3-carboxylate
Cas Number:
307976-20-1
Molecular Formula:
C22H32N2O4
Molecular Weight:
388.5005
Mdl Number:
MFCD13191515
Smiles:
CCOC(=O)C1CN(CC1C1(CC1)NC(=O)OC(C)(C)C)Cc1ccccc1
Complexity:
561
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Rotatable Bond Count:
9
Undefined Atom Stereocenter Count:
2
Xlogp3:
3.1
Catalog Number: AX06818
Chemical Name: (Meso-1r,5s,6s)-3-oxabicyclo[3.1.0]hexan-6-amine
Cas Number: 1285720-68-4
Molecular Formula: C5H10ClNO
Molecular Weight: 135.592
Mdl Number: MFCD30471969
Smiles: N[C@@H]1[C@H]2[C@@H]1COC2.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:
AX06818
Chemical Name:
(Meso-1r,5s,6s)-3-oxabicyclo[3.1.0]hexan-6-amine
Cas Number:
1285720-68-4
Molecular Formula:
C5H10ClNO
Molecular Weight:
135.592
Mdl Number:
MFCD30471969
Smiles:
N[C@@H]1[C@H]2[C@@H]1COC2.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: __
Chemical Name: __
Cas Number: __
Molecular Formula: __
Molecular Weight: __
Mdl Number: __
Smiles: CCOc1ccc(cc1)C(c1cc(I)ccc1Cl)O
Complexity: 269
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Undefined Atom Stereocenter Count: __
Xlogp3: 4.3
Catalog Number:
__
Chemical Name:
__
Cas Number:
__
Molecular Formula:
__
Molecular Weight:
__
Mdl Number:
__
Smiles:
CCOc1ccc(cc1)C(c1cc(I)ccc1Cl)O
Complexity:
269
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
4.3
Catalog Number: AX06820
Chemical Name: 2-(2-(4-((3-chlorophenyl)(phenyl)methyl)piperazin-1-yl)ethoxy)acetic acid
Cas Number: 1232460-31-9
Molecular Formula: C21H25ClN2O3
Molecular Weight: 388.8878
Mdl Number: __
Smiles: OC(=O)COCCN1CCN(CC1)C(c1cccc(c1)Cl)c1ccccc1
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:
AX06820
Chemical Name:
2-(2-(4-((3-chlorophenyl)(phenyl)methyl)piperazin-1-yl)ethoxy)acetic acid
Cas Number:
1232460-31-9
Molecular Formula:
C21H25ClN2O3
Molecular Weight:
388.8878
Mdl Number:
__
Smiles:
OC(=O)COCCN1CCN(CC1)C(c1cccc(c1)Cl)c1ccccc1
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
__