AC70955
77516-53-1 | N-Cyclohexyl-2-nitrobenzenesulfonamide
Manufacturer: A2B Chem
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CatalogNumber
AC70955
ChemicalName
N-Cyclohexyl-2-nitrobenzenesulfonamide
CasNumber
77516-53-1
MolecularFormula
C26H36N4O4
MolecularWeight
468.5884
MdlNumber
MFCD00436909
Smiles
CC1COCC(N1C(=O)C[n+]1ccc(cc1)c1cc[n+](cc1)CC(=O)N1C(C)COCC1C)C
Complexity
406
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.6
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CatalogNumber: AC70955
ChemicalName: N-Cyclohexyl-2-nitrobenzenesulfonamide
CasNumber: 77516-53-1
MolecularFormula: C26H36N4O4
MolecularWeight: 468.5884
MdlNumber: MFCD00436909
Smiles: CC1COCC(N1C(=O)C[n+]1ccc(cc1)c1cc[n+](cc1)CC(=O)N1C(C)COCC1C)C
Complexity: 406
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AC70955
ChemicalName:
N-Cyclohexyl-2-nitrobenzenesulfonamide
CasNumber:
77516-53-1
MolecularFormula:
C26H36N4O4
MolecularWeight:
468.5884
MdlNumber:
MFCD00436909
Smiles:
CC1COCC(N1C(=O)C[n+]1ccc(cc1)c1cc[n+](cc1)CC(=O)N1C(C)COCC1C)C
Complexity:
406
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.6
CatalogNumber: AC70957
ChemicalName: Benzyl 3-hydroxybenzoate
CasNumber: 77513-40-7
MolecularFormula: C14H12O3
MolecularWeight: 228.2433
MdlNumber: MFCD11225903
Smiles: Oc1cccc(c1)C(=O)OCc1ccccc1
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.6
CatalogNumber:
AC70957
ChemicalName:
Benzyl 3-hydroxybenzoate
CasNumber:
77513-40-7
MolecularFormula:
C14H12O3
MolecularWeight:
228.2433
MdlNumber:
MFCD11225903
Smiles:
Oc1cccc(c1)C(=O)OCc1ccccc1
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1ccc2c(c1)sc(n2)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1ccc2c(c1)sc(n2)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AC70961
ChemicalName: 2-Bromo-8-methylquinoline
CasNumber: 99073-81-1
MolecularFormula: C10H8BrN
MolecularWeight: 222.0812
MdlNumber: MFCD16295127
Smiles: Brc1ccc2c(n1)c(C)ccc2
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.6
CatalogNumber:
AC70961
ChemicalName:
2-Bromo-8-methylquinoline
CasNumber:
99073-81-1
MolecularFormula:
C10H8BrN
MolecularWeight:
222.0812
MdlNumber:
MFCD16295127
Smiles:
Brc1ccc2c(n1)c(C)ccc2
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.6