AG36235
53316-57-7 | 6-Amino-3-methyl-1,4-diphenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AG36235
ChemicalName
6-Amino-3-methyl-1,4-diphenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CasNumber
53316-57-7
MolecularFormula
C20H16N4O
MolecularWeight
328.3672
MdlNumber
MFCD00218708
Smiles
N#CC1=C(N)Oc2c(C1c1ccccc1)c(C)nn2c1ccccc1
NscNumber
298889
Complexity
568
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
4
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CatalogNumber: AG36235
ChemicalName: 6-Amino-3-methyl-1,4-diphenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CasNumber: 53316-57-7
MolecularFormula: C20H16N4O
MolecularWeight: 328.3672
MdlNumber: MFCD00218708
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1)c(C)nn2c1ccccc1
NscNumber: 298889
Complexity: 568
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 4
CatalogNumber:
AG36235
ChemicalName:
6-Amino-3-methyl-1,4-diphenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CasNumber:
53316-57-7
MolecularFormula:
C20H16N4O
MolecularWeight:
328.3672
MdlNumber:
MFCD00218708
Smiles:
N#CC1=C(N)Oc2c(C1c1ccccc1)c(C)nn2c1ccccc1
NscNumber:
298889
Complexity:
568
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
4
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Smiles: Clc1ccc2c(c1)c(=O)n(cn2)N
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Smiles:
Clc1ccc2c(c1)c(=O)n(cn2)N
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Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
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__
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Smiles: O=C(c1oc2c(c1N)cccc2)c1ccccc1
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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UndefinedAtomStereocenterCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
O=C(c1oc2c(c1N)cccc2)c1ccccc1
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C(c1sc2c(c1N)c(cc(n2)c1ccccc1)C(F)(F)F)Nc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1sc2c(c1N)c(cc(n2)c1ccccc1)C(F)(F)F)Nc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__