AF09951
191868-23-2 | 1-(4-Cyanophenyl)-n-methylmethanesulfonamide
Manufacturer: A2B Chem
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CatalogNumber
AF09951
ChemicalName
1-(4-Cyanophenyl)-n-methylmethanesulfonamide
CasNumber
191868-23-2
MolecularFormula
C9H10N2O2S
MolecularWeight
210.2529
MdlNumber
MFCD08271852
Smiles
CNS(=O)(=O)Cc1ccc(cc1)C#N
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.5
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CatalogNumber: AF09951
ChemicalName: 1-(4-Cyanophenyl)-n-methylmethanesulfonamide
CasNumber: 191868-23-2
MolecularFormula: C9H10N2O2S
MolecularWeight: 210.2529
MdlNumber: MFCD08271852
Smiles: CNS(=O)(=O)Cc1ccc(cc1)C#N
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.5
CatalogNumber:
AF09951
ChemicalName:
1-(4-Cyanophenyl)-n-methylmethanesulfonamide
CasNumber:
191868-23-2
MolecularFormula:
C9H10N2O2S
MolecularWeight:
210.2529
MdlNumber:
MFCD08271852
Smiles:
CNS(=O)(=O)Cc1ccc(cc1)C#N
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CCN(c1ccc2c(c1)oc1-c(c2C#N)ccc(=[N+](CCCCCC(=O)N2CCN(CC2)CCN2C(=O)C=CC2=O)CC)c1)CC.[Cl-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCN(c1ccc2c(c1)oc1-c(c2C#N)ccc(=[N+](CCCCCC(=O)N2CCN(CC2)CCN2C(=O)C=CC2=O)CC)c1)CC.[Cl-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCC(=O)Nc1ccc(cc1F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
N#CCC(=O)Nc1ccc(cc1F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCNC(=O)OCCN(c1ccc(cc1)/N=N/c1ccc(cc1C#N)[N+](=O)[O-])CCC#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCNC(=O)OCCN(c1ccc(cc1)/N=N/c1ccc(cc1C#N)[N+](=O)[O-])CCC#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__