4-(3-chlorophenyl)-11-methyl-5-(2-phenylethylamino)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
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![4-(3-chlorophenyl)-11-methyl-5-(2-phenylethylamino)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e7a2a81d562f45dfa4954fddce90c37d.png "4-(3-chlorophenyl)-11-methyl-5-(2-phenylethylamino)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one")
4-(3-chlorophenyl)-11-methyl-5-(2-phenylethylamino)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
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CAS No:
844830-00-8
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Formula:
C24H23ClN4OS
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Chemical Name:
4-(3-chlorophenyl)-11-methyl-5-(2-phenylethylamino)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
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Synonyms:
STK575009;ZINC20358294;AKOS005499731;MCULE-9179688279;3-(3-chlorophenyl)-7-methyl-2-[(2-phenylethyl)amino]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;844830-00-8
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CAS No:
4-(3-chlorophenyl)-11-methyl-5-(2-phenylethylamino)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes
451.0 g/mol
450.1281102 g/mol
Computed Properties
Molecular Weight:451.0
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:450.1281102
Monoisotopic Mass:450.1281102
Topological Polar Surface Area:76.2
Heavy Atom Count:31
Complexity:685
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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