AE99616
153524-69-7 | Ethyl (s)-3-(3-pyridyl)-beta-alanate DiHCl
Manufacturer: A2B Chem
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CatalogNumber
AE99616
ChemicalName
Ethyl (s)-3-(3-pyridyl)-beta-alanate DiHCl
CasNumber
153524-69-7
MolecularFormula
C10H16Cl2N2O2
MolecularWeight
267.1522
MdlNumber
MFCD06796541
Smiles
CCOC(=O)C[C@@H](c1cccnc1)N.Cl.Cl
Complexity
185
Covalently-bondedUnitCount
3
DefinedAtomStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
5
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CatalogNumber: AE99616
ChemicalName: Ethyl (s)-3-(3-pyridyl)-beta-alanate DiHCl
CasNumber: 153524-69-7
MolecularFormula: C10H16Cl2N2O2
MolecularWeight: 267.1522
MdlNumber: MFCD06796541
Smiles: CCOC(=O)C[C@@H](c1cccnc1)N.Cl.Cl
Complexity: 185
Covalently-bondedUnitCount: 3
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 5
CatalogNumber:
AE99616
ChemicalName:
Ethyl (s)-3-(3-pyridyl)-beta-alanate DiHCl
CasNumber:
153524-69-7
MolecularFormula:
C10H16Cl2N2O2
MolecularWeight:
267.1522
MdlNumber:
MFCD06796541
Smiles:
CCOC(=O)C[C@@H](c1cccnc1)N.Cl.Cl
Complexity:
185
Covalently-bondedUnitCount:
3
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@@H]([C@H](c1ccccc1)NCc1ccccc1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O[C@@H]([C@H](c1ccccc1)NCc1ccccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC([C@@H](C(=O)N1Cc2ccccc2CC1C(=O)OCc1ccccc1)N)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC([C@@H](C(=O)N1Cc2ccccc2CC1C(=O)OCc1ccccc1)N)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N[C@H](C(=O)O)C[C@@H](C(=O)O)Cc1ccc(cc1)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@H](C(=O)O)C[C@@H](C(=O)O)Cc1ccc(cc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__