2-{[4-amino-5-(4-methylbenzoyl)thieno[3,2-d]isothiazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone
-
![2-{[4-amino-5-(4-methylbenzoyl)thieno[3,2-d]isothiazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d593af172410474298acd3ff58a274cd.png "2-{[4-amino-5-(4-methylbenzoyl)thieno[3,2-d]isothiazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone")
2-{[4-amino-5-(4-methylbenzoyl)thieno[3,2-d]isothiazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone
structure -
-
CAS No:
311326-65-5
-
Formula:
C22H18N2O2S3
-
Chemical Name:
2-{[4-amino-5-(4-methylbenzoyl)thieno[3,2-d]isothiazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone
-
Synonyms:
2-{[4-amino-5-(4-methylbenzoyl)thieno[3,2-d]isothiazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone;CBKinase1_008495;CBKinase1_020895;Oprea1_080268;ZINC2051232;RSC000733;STK754988;AKOS001707312;MCULE-2830288928;AK-777/10805006
-
CAS No:
2-{[4-amino-5-(4-methylbenzoyl)thieno[3,2-d]isothiazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone Basic Attributes
438.58552
438.053
Computed Properties
Molecular Weight:438.6
XLogP3:6.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:438.05304134
Monoisotopic Mass:438.05304134
Topological Polar Surface Area:155
Heavy Atom Count:29
Complexity:603
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation