AB63301
252928-82-8 | 3-(1,3-Oxazol-5-yl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB63301
ChemicalName
3-(1,3-Oxazol-5-yl)benzoic acid
CasNumber
252928-82-8
MolecularFormula
C10H7NO3
MolecularWeight
189.1675
MdlNumber
MFCD06797481
Smiles
OC(=O)c1cccc(c1)c1cnco1
Complexity
219
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AB63301
ChemicalName: 3-(1,3-Oxazol-5-yl)benzoic acid
CasNumber: 252928-82-8
MolecularFormula: C10H7NO3
MolecularWeight: 189.1675
MdlNumber: MFCD06797481
Smiles: OC(=O)c1cccc(c1)c1cnco1
Complexity: 219
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AB63301
ChemicalName:
3-(1,3-Oxazol-5-yl)benzoic acid
CasNumber:
252928-82-8
MolecularFormula:
C10H7NO3
MolecularWeight:
189.1675
MdlNumber:
MFCD06797481
Smiles:
OC(=O)c1cccc(c1)c1cnco1
Complexity:
219
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: AB63302
ChemicalName: tert-Butyl 3-(6-amino-3-methylpyridin-2-yl)benzoate
CasNumber: 1083057-14-0
MolecularFormula: C17H20N2O2
MolecularWeight: 284.3529
MdlNumber: MFCD16659611
Smiles: Nc1ccc(c(n1)c1cccc(c1)C(=O)OC(C)(C)C)C
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.4
CatalogNumber:
AB63302
ChemicalName:
tert-Butyl 3-(6-amino-3-methylpyridin-2-yl)benzoate
CasNumber:
1083057-14-0
MolecularFormula:
C17H20N2O2
MolecularWeight:
284.3529
MdlNumber:
MFCD16659611
Smiles:
Nc1ccc(c(n1)c1cccc(c1)C(=O)OC(C)(C)C)C
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)/C=C/c1ccc(nc1)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)/C=C/c1ccc(nc1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB63304
ChemicalName: 3-(6-Chloropyridazin-3-yl)benzoic acid
CasNumber: 914349-46-5
MolecularFormula: C11H7ClN2O2
MolecularWeight: 234.6385
MdlNumber: MFCD05864817
Smiles: Clc1ccc(nn1)c1cccc(c1)C(=O)O
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AB63304
ChemicalName:
3-(6-Chloropyridazin-3-yl)benzoic acid
CasNumber:
914349-46-5
MolecularFormula:
C11H7ClN2O2
MolecularWeight:
234.6385
MdlNumber:
MFCD05864817
Smiles:
Clc1ccc(nn1)c1cccc(c1)C(=O)O
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2