AF68016
422513-13-1 | Hesperadin
Manufacturer: A2B Chem
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CatalogNumber
AF68016
ChemicalName
Hesperadin
CasNumber
422513-13-1
MolecularFormula
C29H32N4O3S
MolecularWeight
516.6544
MdlNumber
MFCD18074526
Smiles
CCS(=O)(=O)Nc1ccc2c(c1)/C(=C(c1ccccc1)/Nc1ccc(cc1)CN1CCCCC1)/C(=O)N2
Complexity
855
Covalently-bondedUnitCount
1
HeavyAtomCount
37
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
8
Xlogp3
5.2
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CatalogNumber: AF68016
ChemicalName: Hesperadin
CasNumber: 422513-13-1
MolecularFormula: C29H32N4O3S
MolecularWeight: 516.6544
MdlNumber: MFCD18074526
Smiles: CCS(=O)(=O)Nc1ccc2c(c1)/C(=C(c1ccccc1)/Nc1ccc(cc1)CN1CCCCC1)/C(=O)N2
Complexity: 855
Covalently-bondedUnitCount: 1
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 8
Xlogp3: 5.2
CatalogNumber:
AF68016
ChemicalName:
Hesperadin
CasNumber:
422513-13-1
MolecularFormula:
C29H32N4O3S
MolecularWeight:
516.6544
MdlNumber:
MFCD18074526
Smiles:
CCS(=O)(=O)Nc1ccc2c(c1)/C(=C(c1ccccc1)/Nc1ccc(cc1)CN1CCCCC1)/C(=O)N2
Complexity:
855
Covalently-bondedUnitCount:
1
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
8
Xlogp3:
5.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1ccc(cc1C)C(c1ccc2c(c1O)nc(cc2)C)Nc1ccccn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
CCOc1ccc(cc1C)C(c1ccc2c(c1O)nc(cc2)C)Nc1ccccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCc1cccc(c1)C
Complexity: 154
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCc1cccc(c1)C
Complexity:
154
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(c1=O)CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(c1=O)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__