2-(3,4-dihydro-2H-quinolin-1-ylmethyl)-N-(4-methoxyphenyl)-6-methyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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![2-(3,4-dihydro-2H-quinolin-1-ylmethyl)-N-(4-methoxyphenyl)-6-methyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/08b2b8a062de49b2b9d11ba77e99dc57.png "2-(3,4-dihydro-2H-quinolin-1-ylmethyl)-N-(4-methoxyphenyl)-6-methyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide")
2-(3,4-dihydro-2H-quinolin-1-ylmethyl)-N-(4-methoxyphenyl)-6-methyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
structure -
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CAS No:
726146-07-2
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Formula:
C28H31N5OS
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Chemical Name:
2-(3,4-dihydro-2H-quinolin-1-ylmethyl)-N-(4-methoxyphenyl)-6-methyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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Synonyms:
ZINC3265855;AKOS034463547;MCULE-5478796394;Z56880536;726146-07-2;N-(4-methoxyphenyl)-6-methyl-2-[(1,2,3,4-tetrahydroquinolin-1-yl)methyl]-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene-5-carbothioamide
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CAS No:
2-(3,4-dihydro-2H-quinolin-1-ylmethyl)-N-(4-methoxyphenyl)-6-methyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
485.6 g/mol
485.22493180 g/mol
Computed Properties
Molecular Weight:485.6
XLogP3:5.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:485.22493180
Monoisotopic Mass:485.22493180
Topological Polar Surface Area:78.8
Heavy Atom Count:35
Complexity:745
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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