N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide
Compound characteristics
Compound ID: | D336-0077 |
Compound Name: | N-(2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)thiophene-2-carboxamide |
Molecular Weight: | 419.54 |
Molecular Formula: | C18 H17 N3 O3 S3 |
Smiles: | C1COCCN1C(CSc1nc2ccc(cc2s1)NC(c1cccs1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1564 |
logD: | 3.1563 |
logSw: | -3.3557 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.459 |
InChI Key: | BOWBGUCDHVVFPZ-UHFFFAOYSA-N |