AD71874
139755-82-1 | N-Desmethyl sildenafil
Manufacturer: A2B Chem
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CatalogNumber
AD71874
ChemicalName
N-Desmethyl sildenafil
CasNumber
139755-82-1
MolecularFormula
C21H28N6O4S
MolecularWeight
460.5498
MdlNumber
MFCD00908398
Smiles
CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCNCC1)C
Complexity
810
Covalently-bondedUnitCount
1
HeavyAtomCount
32
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
1
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CatalogNumber: AD71874
ChemicalName: N-Desmethyl sildenafil
CasNumber: 139755-82-1
MolecularFormula: C21H28N6O4S
MolecularWeight: 460.5498
MdlNumber: MFCD00908398
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCNCC1)C
Complexity: 810
Covalently-bondedUnitCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 1
CatalogNumber:
AD71874
ChemicalName:
N-Desmethyl sildenafil
CasNumber:
139755-82-1
MolecularFormula:
C21H28N6O4S
MolecularWeight:
460.5498
MdlNumber:
MFCD00908398
Smiles:
CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCNCC1)C
Complexity:
810
Covalently-bondedUnitCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)C=C1CCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COC(=O)C=C1CCC1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CCCCCCCOc1ccc(cc1)C(=O)CCC(=O)OCC
Complexity: __
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Smiles:
CCCCCCCOc1ccc(cc1)C(=O)CCC(=O)OCC
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: COCCOCCOCCOCCI
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HydrogenBondDonorCount: __
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Smiles:
COCCOCCOCCOCCI
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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