AB53578
1338540-63-8 | (R)-9-(4-(1-aminopropan-2-yl)phenyl)-8-hydroxy-6-methylthieno[2,3-c]quinolin-4(5H)-one
Manufacturer: A2B Chem
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CatalogNumber
AB53578
ChemicalName
(R)-9-(4-(1-aminopropan-2-yl)phenyl)-8-hydroxy-6-methylthieno[2,3-c]quinolin-4(5H)-one
CasNumber
1338540-63-8
MolecularFormula
C21H20N2O2S
MolecularWeight
364.4607
MdlNumber
MFCD29924710
Smiles
NC[C@@H](c1ccc(cc1)c1c(O)cc(c2c1c1ccsc1c(=O)[nH]2)C)C
Complexity
522
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
3
Xlogp3
3.8
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CatalogNumber: AB53578
ChemicalName: (R)-9-(4-(1-aminopropan-2-yl)phenyl)-8-hydroxy-6-methylthieno[2,3-c]quinolin-4(5H)-one
CasNumber: 1338540-63-8
MolecularFormula: C21H20N2O2S
MolecularWeight: 364.4607
MdlNumber: MFCD29924710
Smiles: NC[C@@H](c1ccc(cc1)c1c(O)cc(c2c1c1ccsc1c(=O)[nH]2)C)C
Complexity: 522
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: 3.8
CatalogNumber:
AB53578
ChemicalName:
(R)-9-(4-(1-aminopropan-2-yl)phenyl)-8-hydroxy-6-methylthieno[2,3-c]quinolin-4(5H)-one
CasNumber:
1338540-63-8
MolecularFormula:
C21H20N2O2S
MolecularWeight:
364.4607
MdlNumber:
MFCD29924710
Smiles:
NC[C@@H](c1ccc(cc1)c1c(O)cc(c2c1c1ccsc1c(=O)[nH]2)C)C
Complexity:
522
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
3.8
CatalogNumber: __
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Smiles: COC(=O)c1cc(Cl)c(c(c1)Cl)C(=O)OC
Complexity: __
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Smiles:
COC(=O)c1cc(Cl)c(c(c1)Cl)C(=O)OC
Complexity:
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__
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RotatableBondCount:
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Smiles: CO/N=C/NC(=O)c1ccc(cc1C)C1=NOC(C1)(c1cc(Cl)cc(c1)Cl)C(F)(F)F
Complexity: __
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Xlogp3: __
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__
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__
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MolecularWeight:
__
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Smiles:
CO/N=C/NC(=O)c1ccc(cc1C)C1=NOC(C1)(c1cc(Cl)cc(c1)Cl)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: Nc1cnc(c(c1)F)N1CCOCC1
Complexity: __
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1cnc(c(c1)F)N1CCOCC1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__