N-[(4-butoxyphenyl)methyl]-3-[(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]propanamide
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![N-[(4-butoxyphenyl)methyl]-3-[(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]propanamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4abca7f315a34babb6814b2ca04b75a5.png "N-[(4-butoxyphenyl)methyl]-3-[(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]propanamide")
N-[(4-butoxyphenyl)methyl]-3-[(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]propanamide
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CAS No:
330179-54-9
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Formula:
C25H31N3O4S2
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Chemical Name:
N-[(4-butoxyphenyl)methyl]-3-[(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]propanamide
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Synonyms:
ZINC1875870;STK002528;AKOS030506887;MCULE-9286455709;330179-54-9;N-(4-butoxybenzyl)-3-((6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide;N-(4-butoxybenzyl)-3-[(6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanamide
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CAS No:
N-[(4-butoxyphenyl)methyl]-3-[(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]propanamide Basic Attributes
501.7 g/mol
501.17559883 g/mol
Computed Properties
Molecular Weight:501.7
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:501.17559883
Monoisotopic Mass:501.17559883
Topological Polar Surface Area:143
Heavy Atom Count:34
Complexity:754
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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