N-[(4-chlorophenyl)methyl]-3-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)propanamide
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![N-[(4-chlorophenyl)methyl]-3-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)propanamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e02b489919f642c8b971d15e33673de8.png "N-[(4-chlorophenyl)methyl]-3-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)propanamide")
N-[(4-chlorophenyl)methyl]-3-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)propanamide
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CAS No:
732997-38-5
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Formula:
C20H20ClN3O2S
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Chemical Name:
N-[(4-chlorophenyl)methyl]-3-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)propanamide
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Synonyms:
ZINC3324801;AKOS034025051;MCULE-9314745643;Z27723228;732997-38-5;N-[(4-chlorophenyl)methyl]-3-{3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}propanamide
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CAS No:
N-[(4-chlorophenyl)methyl]-3-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)propanamide Basic Attributes
401.9 g/mol
401.0964758 g/mol
Computed Properties
Molecular Weight:401.9
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:401.0964758
Monoisotopic Mass:401.0964758
Topological Polar Surface Area:98.8
Heavy Atom Count:27
Complexity:606
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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