AH51098
7497-07-6 | Nsc 405020
Manufacturer: A2B Chem
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CatalogNumber
AH51098
ChemicalName
Nsc 405020
CasNumber
7497-07-6
MolecularFormula
C12H15Cl2NO
MolecularWeight
260.1596
MdlNumber
MFCD02006898
Smiles
CCCC(NC(=O)c1ccc(c(c1)Cl)Cl)C
NscNumber
405020
Complexity
235
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
4.9
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CatalogNumber: AH51098
ChemicalName: Nsc 405020
CasNumber: 7497-07-6
MolecularFormula: C12H15Cl2NO
MolecularWeight: 260.1596
MdlNumber: MFCD02006898
Smiles: CCCC(NC(=O)c1ccc(c(c1)Cl)Cl)C
NscNumber: 405020
Complexity: 235
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 4.9
CatalogNumber:
AH51098
ChemicalName:
Nsc 405020
CasNumber:
7497-07-6
MolecularFormula:
C12H15Cl2NO
MolecularWeight:
260.1596
MdlNumber:
MFCD02006898
Smiles:
CCCC(NC(=O)c1ccc(c(c1)Cl)Cl)C
NscNumber:
405020
Complexity:
235
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
4.9
CatalogNumber: AH51099
ChemicalName: Nvp-tae684
CasNumber: 761439-42-3
MolecularFormula: C30H40ClN7O3S
MolecularWeight: 614.2017
MdlNumber: MFCD11977634
Smiles: COc1cc(ccc1Nc1ncc(c(n1)Nc1ccccc1S(=O)(=O)C(C)C)Cl)N1CCC(CC1)N1CCN(CC1)C
NscNumber: __
Complexity: 940
Covalently-bondedUnitCount: 1
HeavyAtomCount: 42
HydrogenBondAcceptorCount: 10
HydrogenBondDonorCount: 2
RotatableBondCount: 9
UndefinedAtomStereocenterCount: __
Xlogp3: 5.7
CatalogNumber:
AH51099
ChemicalName:
Nvp-tae684
CasNumber:
761439-42-3
MolecularFormula:
C30H40ClN7O3S
MolecularWeight:
614.2017
MdlNumber:
MFCD11977634
Smiles:
COc1cc(ccc1Nc1ncc(c(n1)Nc1ccccc1S(=O)(=O)C(C)C)Cl)N1CCC(CC1)N1CCN(CC1)C
NscNumber:
__
Complexity:
940
Covalently-bondedUnitCount:
1
HeavyAtomCount:
42
HydrogenBondAcceptorCount:
10
HydrogenBondDonorCount:
2
RotatableBondCount:
9
UndefinedAtomStereocenterCount:
__
Xlogp3:
5.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ONC(=O)c1ccc(cc1)OCCNC(=O)c1oc2c(c1CN(C)C)cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ONC(=O)c1ccc(cc1)OCCNC(=O)c1oc2c(c1CN(C)C)cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNC(=O)c1nn(c2-c3nc(ncc3CC(c12)(C)C)Nc1ccc(cc1)N1CCN(CC1)C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNC(=O)c1nn(c2-c3nc(ncc3CC(c12)(C)C)Nc1ccc(cc1)N1CCN(CC1)C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__