11,12,12-trimethyl-4-prop-2-enyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
-
![11,12,12-trimethyl-4-prop-2-enyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2e12c29892de440990d1ee708f705831.png "11,12,12-trimethyl-4-prop-2-enyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one")
11,12,12-trimethyl-4-prop-2-enyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
structure -
-
CAS No:
866571-90-6
-
Formula:
C15H19N3OS2
-
Chemical Name:
11,12,12-trimethyl-4-prop-2-enyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
-
Synonyms:
STL581309;ZINC20840828;AKOS030508423;MCULE-6139982527;3-Allyl-6,6,7-trimethyl-2-thioxo-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one;3-Allyl-6,6,7-trimethyl-2-thioxo-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one #;6,6,7-trimethyl-3-(prop-2-en-1-yl)-2-sulfanyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;866571-90-6;Pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one, 2,3,5,6,7,8-hexahydro-3-allyl-6,6,7-trimethyl-2-thioxo-
-
CAS No:
11,12,12-trimethyl-4-prop-2-enyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one Basic Attributes
321.5 g/mol
321.09695459 g/mol
Computed Properties
Molecular Weight:321.5
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:321.09695459
Monoisotopic Mass:321.09695459
Topological Polar Surface Area:95.9
Heavy Atom Count:21
Complexity:493
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation