N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide
N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | 8010-3974 |
Compound Name: | N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide |
Molecular Weight: | 559.69 |
Molecular Formula: | C26 H21 N7 O2 S3 |
Smiles: | C1CN(C(CSc2nc3ccc(cc3s2)NC(CSc2nnnn2c2ccccc2)=O)=O)c2ccccc12 |
Stereo: | ACHIRAL |
logP: | 4.9914 |
logD: | 4.9914 |
logSw: | -4.7809 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.271 |
InChI Key: | WONSVQAKURBLPE-UHFFFAOYSA-N |