AC71817
70593-57-6 | 4,6-Dichloronicotinamide
Manufacturer: A2B Chem
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CatalogNumber
AC71817
ChemicalName
4,6-Dichloronicotinamide
CasNumber
70593-57-6
MolecularFormula
C6H4Cl2N2O
MolecularWeight
191.0148
MdlNumber
MFCD01646073
Smiles
NC(=O)c1cnc(cc1Cl)Cl
Complexity
165
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.3
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CatalogNumber: AC71817
ChemicalName: 4,6-Dichloronicotinamide
CasNumber: 70593-57-6
MolecularFormula: C6H4Cl2N2O
MolecularWeight: 191.0148
MdlNumber: MFCD01646073
Smiles: NC(=O)c1cnc(cc1Cl)Cl
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AC71817
ChemicalName:
4,6-Dichloronicotinamide
CasNumber:
70593-57-6
MolecularFormula:
C6H4Cl2N2O
MolecularWeight:
191.0148
MdlNumber:
MFCD01646073
Smiles:
NC(=O)c1cnc(cc1Cl)Cl
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: __
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Smiles: COC(C1Cc2cc3cc(OC4CC(OC5CC(O)C(C(O5)C)OC)C(C(O4)C)OC(=O)C)c(c(c3c(c2C(=O)C1OC1CC(OC2CC(OC3OC(C)C(C(C3)(C)O)OC(=O)C)C(C(O2)C)O)C(C(O1)C)O)O)O)C)C(=O)C(C(O)C)O
Complexity: __
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Smiles:
COC(C1Cc2cc3cc(OC4CC(OC5CC(O)C(C(O5)C)OC)C(C(O4)C)OC(=O)C)c(c(c3c(c2C(=O)C1OC1CC(OC2CC(OC3OC(C)C(C(C3)(C)O)OC(=O)C)C(C(O2)C)O)C(C(O1)C)O)O)O)C)C(=O)C(C(O)C)O
Complexity:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
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Smiles: OC[C@H]1O[C@H]([C@@H]([C@@H]1N=[N+]=[N-])O)n1ccc(=O)[nH]c1=O
Complexity: __
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Smiles:
OC[C@H]1O[C@H]([C@@H]([C@@H]1N=[N+]=[N-])O)n1ccc(=O)[nH]c1=O
Complexity:
__
Covalently-bondedUnitCount:
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Smiles: c1ccc(cc1)N1C2Sc3c(C1Sc1c2cccn1)cccn3
Complexity: __
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HydrogenBondDonorCount: __
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Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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Smiles:
c1ccc(cc1)N1C2Sc3c(C1Sc1c2cccn1)cccn3
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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