AV18463
1932638-86-2 | 5-O-benzyl 1-O-tert-butyl (3aS,6aS)-3a,4,6,6a-tetrahydro-3H-pyrrolo[3,4-c][1,2]oxazole-1,5-dicarboxylate
Manufacturer: A2B Chem
CAS Number: 1932638-86-2
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Catalog Number
AV18463
Chemical Name
5-O-benzyl 1-O-tert-butyl (3aS,6aS)-3a,4,6,6a-tetrahydro-3H-pyrrolo[3,4-c][1,2]oxazole-1,5-dicarboxylate
Cas Number
1932638-86-2
Molecular Formula
C18H24N2O5
Molecular Weight
348.3936
Mdl Number
MFCD28390335
Smiles
O=C(N1C[C@H]2[C@@H](C1)N(OC2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity
498
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Heavy Atom Count
25
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
5
Xlogp3
2.4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 5-Benzyl 1-(tert-butyl) (3aS,6aS)-tetrahydro-1H-pyrrolo[3,4-c]isoxazole-1,5(3H)-dicarboxylate | ChemScene | ₹ 97,709.52 |
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Catalog Number: AV18463
Chemical Name: 5-O-benzyl 1-O-tert-butyl (3aS,6aS)-3a,4,6,6a-tetrahydro-3H-pyrrolo[3,4-c][1,2]oxazole-1,5-dicarboxylate
Cas Number: 1932638-86-2
Molecular Formula: C18H24N2O5
Molecular Weight: 348.3936
Mdl Number: MFCD28390335
Smiles: O=C(N1C[C@H]2[C@@H](C1)N(OC2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity: 498
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 2
Heavy Atom Count: 25
Hydrogen Bond Acceptor Count: 5
Rotatable Bond Count: 5
Xlogp3: 2.4
Catalog Number:
AV18463
Chemical Name:
5-O-benzyl 1-O-tert-butyl (3aS,6aS)-3a,4,6,6a-tetrahydro-3H-pyrrolo[3,4-c][1,2]oxazole-1,5-dicarboxylate
Cas Number:
1932638-86-2
Molecular Formula:
C18H24N2O5
Molecular Weight:
348.3936
Mdl Number:
MFCD28390335
Smiles:
O=C(N1C[C@H]2[C@@H](C1)N(OC2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity:
498
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Xlogp3:
2.4
Catalog Number: __
Chemical Name: __
Cas Number: __
Molecular Formula: __
Molecular Weight: __
Mdl Number: __
Smiles: Brc1ccc(cc1)c1ccccc1F
Complexity: 175
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: 4.6
Catalog Number:
__
Chemical Name:
__
Cas Number:
__
Molecular Formula:
__
Molecular Weight:
__
Mdl Number:
__
Smiles:
Brc1ccc(cc1)c1ccccc1F
Complexity:
175
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
4.6
Catalog Number: __
Chemical Name: __
Cas Number: __
Molecular Formula: __
Molecular Weight: __
Mdl Number: __
Smiles: CN(/C=C/C(=O)c1cn(c2c1ccnc2)S(=O)(=O)c1ccccc1)C
Complexity: 606
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: 2.2
Catalog Number:
__
Chemical Name:
__
Cas Number:
__
Molecular Formula:
__
Molecular Weight:
__
Mdl Number:
__
Smiles:
CN(/C=C/C(=O)c1cn(c2c1ccnc2)S(=O)(=O)c1ccccc1)C
Complexity:
606
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
2.2
Catalog Number: AV18466
Chemical Name: Ethyl 3-(1-methyl-1H-pyrazol-4-yl)propanoate
Cas Number: 192661-37-3
Molecular Formula: C9H14N2O2
Molecular Weight: 182.2197
Mdl Number: MFCD21642848
Smiles: CCOC(=O)CCc1cnn(c1)C
Complexity: 173
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: __
Heavy Atom Count: 13
Hydrogen Bond Acceptor Count: 3
Rotatable Bond Count: 5
Xlogp3: 0.7
Catalog Number:
AV18466
Chemical Name:
Ethyl 3-(1-methyl-1H-pyrazol-4-yl)propanoate
Cas Number:
192661-37-3
Molecular Formula:
C9H14N2O2
Molecular Weight:
182.2197
Mdl Number:
MFCD21642848
Smiles:
CCOC(=O)CCc1cnn(c1)C
Complexity:
173
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Xlogp3:
0.7