AF31740
241809-79-0 | 4-[(Pyridin-3-ylmethoxycarbonylamino)methyl]benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF31740
ChemicalName
4-[(Pyridin-3-ylmethoxycarbonylamino)methyl]benzoic acid
CasNumber
241809-79-0
MolecularFormula
C15H14N2O4
MolecularWeight
286.2827
MdlNumber
MFCD07357377
Smiles
O=C(OCc1cccnc1)NCc1ccc(cc1)C(=O)O
Complexity
354
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
1.4
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CatalogNumber: AF31740
ChemicalName: 4-[(Pyridin-3-ylmethoxycarbonylamino)methyl]benzoic acid
CasNumber: 241809-79-0
MolecularFormula: C15H14N2O4
MolecularWeight: 286.2827
MdlNumber: MFCD07357377
Smiles: O=C(OCc1cccnc1)NCc1ccc(cc1)C(=O)O
Complexity: 354
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 1.4
CatalogNumber:
AF31740
ChemicalName:
4-[(Pyridin-3-ylmethoxycarbonylamino)methyl]benzoic acid
CasNumber:
241809-79-0
MolecularFormula:
C15H14N2O4
MolecularWeight:
286.2827
MdlNumber:
MFCD07357377
Smiles:
O=C(OCc1cccnc1)NCc1ccc(cc1)C(=O)O
Complexity:
354
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: IC[C@@H]1COC(O1)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
IC[C@@H]1COC(O1)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(C(=O)C(F)(F)F)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)C(C(=O)C(F)(F)F)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: IC[C@H]1COC(O1)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
IC[C@H]1COC(O1)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__