AI40758
1820703-51-2 | 5-Acetamido-3-chloropyridine-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI40758
ChemicalName
5-Acetamido-3-chloropyridine-2-carboxylic acid
CasNumber
1820703-51-2
MolecularFormula
C8H7ClN2O3
MolecularWeight
214.6058
MdlNumber
MFCD28101649
Smiles
CC(=O)Nc1cnc(c(c1)Cl)C(=O)O
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
0.5
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CatalogNumber: AI40758
ChemicalName: 5-Acetamido-3-chloropyridine-2-carboxylic acid
CasNumber: 1820703-51-2
MolecularFormula: C8H7ClN2O3
MolecularWeight: 214.6058
MdlNumber: MFCD28101649
Smiles: CC(=O)Nc1cnc(c(c1)Cl)C(=O)O
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AI40758
ChemicalName:
5-Acetamido-3-chloropyridine-2-carboxylic acid
CasNumber:
1820703-51-2
MolecularFormula:
C8H7ClN2O3
MolecularWeight:
214.6058
MdlNumber:
MFCD28101649
Smiles:
CC(=O)Nc1cnc(c(c1)Cl)C(=O)O
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)Cc1cc(F)ccc1C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)Cc1cc(F)ccc1C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI40761
ChemicalName: 3-Chloro-2-(methylsulfanyl)-5-nitrobenzonitrile
CasNumber: 1820703-59-0
MolecularFormula: C8H5ClN2O2S
MolecularWeight: 228.6555
MdlNumber: MFCD28096659
Smiles: N#Cc1cc(cc(c1SC)Cl)[N+](=O)[O-]
Complexity: 272
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AI40761
ChemicalName:
3-Chloro-2-(methylsulfanyl)-5-nitrobenzonitrile
CasNumber:
1820703-59-0
MolecularFormula:
C8H5ClN2O2S
MolecularWeight:
228.6555
MdlNumber:
MFCD28096659
Smiles:
N#Cc1cc(cc(c1SC)Cl)[N+](=O)[O-]
Complexity:
272
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)Cc1cccc(c1)c1ccc(cc1)C(=O)N(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)Cc1cccc(c1)c1ccc(cc1)C(=O)N(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__