AG79797
5768-34-3 | 4-(2-Furoylamino)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AG79797
ChemicalName
4-(2-Furoylamino)benzoic acid
CasNumber
5768-34-3
MolecularFormula
C12H9NO4
MolecularWeight
231.2042
MdlNumber
MFCD00522706
Smiles
O=C(c1ccco1)Nc1ccc(cc1)C(=O)O
NscNumber
270093
Complexity
297
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
1.3
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CatalogNumber: AG79797
ChemicalName: 4-(2-Furoylamino)benzoic acid
CasNumber: 5768-34-3
MolecularFormula: C12H9NO4
MolecularWeight: 231.2042
MdlNumber: MFCD00522706
Smiles: O=C(c1ccco1)Nc1ccc(cc1)C(=O)O
NscNumber: 270093
Complexity: 297
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.3
CatalogNumber:
AG79797
ChemicalName:
4-(2-Furoylamino)benzoic acid
CasNumber:
5768-34-3
MolecularFormula:
C12H9NO4
MolecularWeight:
231.2042
MdlNumber:
MFCD00522706
Smiles:
O=C(c1ccco1)Nc1ccc(cc1)C(=O)O
NscNumber:
270093
Complexity:
297
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.3
CatalogNumber: AG79798
ChemicalName: 3-Bromo-5-methoxypyridine-4-boronic acid
CasNumber: 612845-45-1
MolecularFormula: C6H7BBrNO3
MolecularWeight: 231.8397
MdlNumber: MFCD11040271
Smiles: COc1cncc(c1B(O)O)Br
NscNumber: __
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AG79798
ChemicalName:
3-Bromo-5-methoxypyridine-4-boronic acid
CasNumber:
612845-45-1
MolecularFormula:
C6H7BBrNO3
MolecularWeight:
231.8397
MdlNumber:
MFCD11040271
Smiles:
COc1cncc(c1B(O)O)Br
NscNumber:
__
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: AG79799
ChemicalName: Ethyl 1-cyclohexyl-1,3-benzodiazole-5-carboxylate
CasNumber: 637041-83-9
MolecularFormula: C16H20N2O2
MolecularWeight: 272.3422
MdlNumber: MFCD25953939
Smiles: CCOC(=O)c1ccc2c(c1)ncn2C1CCCCC1
NscNumber: __
Complexity: 341
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 3.4
CatalogNumber:
AG79799
ChemicalName:
Ethyl 1-cyclohexyl-1,3-benzodiazole-5-carboxylate
CasNumber:
637041-83-9
MolecularFormula:
C16H20N2O2
MolecularWeight:
272.3422
MdlNumber:
MFCD25953939
Smiles:
CCOC(=O)c1ccc2c(c1)ncn2C1CCCCC1
NscNumber:
__
Complexity:
341
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
3.4
CatalogNumber: AG79801
ChemicalName: Ethyl benzimidazole-5-carboxylate
CasNumber: 58842-61-8
MolecularFormula: C10H10N2O2
MolecularWeight: 190.1986
MdlNumber: MFCD09027455
Smiles: CCOC(=O)c1ccc2c(c1)nc[nH]2
NscNumber: __
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AG79801
ChemicalName:
Ethyl benzimidazole-5-carboxylate
CasNumber:
58842-61-8
MolecularFormula:
C10H10N2O2
MolecularWeight:
190.1986
MdlNumber:
MFCD09027455
Smiles:
CCOC(=O)c1ccc2c(c1)nc[nH]2
NscNumber:
__
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2