AA41063
1312756-38-9 | (3aS,6aS)-1-Methyl-hexahydro-2H-pyrrolo[2,3-c]pyrrole
Manufacturer: A2B Chem
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CatalogNumber
AA41063
ChemicalName
(3aS,6aS)-1-Methyl-hexahydro-2H-pyrrolo[2,3-c]pyrrole
CasNumber
1312756-38-9
MolecularFormula
C7H14N2
MolecularWeight
126.1995
MdlNumber
MFCD11656777
Smiles
CN1CC[C@@H]2[C@H]1CNC2
Complexity
114
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
Xlogp3
0.1
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CatalogNumber: AA41063
ChemicalName: (3aS,6aS)-1-Methyl-hexahydro-2H-pyrrolo[2,3-c]pyrrole
CasNumber: 1312756-38-9
MolecularFormula: C7H14N2
MolecularWeight: 126.1995
MdlNumber: MFCD11656777
Smiles: CN1CC[C@@H]2[C@H]1CNC2
Complexity: 114
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
Xlogp3: 0.1
CatalogNumber:
AA41063
ChemicalName:
(3aS,6aS)-1-Methyl-hexahydro-2H-pyrrolo[2,3-c]pyrrole
CasNumber:
1312756-38-9
MolecularFormula:
C7H14N2
MolecularWeight:
126.1995
MdlNumber:
MFCD11656777
Smiles:
CN1CC[C@@H]2[C@H]1CNC2
Complexity:
114
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)O[C@H]([C@]1(C)[C@H]2CCC=C([C@]2(C)[C@H]([C@@H]([C@]1(C)O)OC(=O)c1cccnc1)OC(=O)c1cccnc1)C)CC1=C(O)C(=O)OC1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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Smiles:
CC(=O)O[C@H]([C@]1(C)[C@H]2CCC=C([C@]2(C)[C@H]([C@@H]([C@]1(C)O)OC(=O)c1cccnc1)OC(=O)c1cccnc1)C)CC1=C(O)C(=O)OC1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C(N1CCC(C1)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
O=C(N1CCC(C1)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
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MolecularFormula: __
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Smiles: CCCCCCCCCCCCCCOCC(CNC(=O)CCCCCCCC(C(CCCCCCO)O)O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
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HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCCCCCCCCOCC(CNC(=O)CCCCCCCC(C(CCCCCCO)O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__