N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2,3-dihydro-1H-indole-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2,3-dihydro-1H-indole-1-sulfonyl)benzamide
N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2,3-dihydro-1H-indole-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 3339-1510 |
| Compound Name: | N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2,3-dihydro-1H-indole-1-sulfonyl)benzamide |
| Molecular Weight: | 585.77 |
| Molecular Formula: | C31 H27 N3 O3 S3 |
| Smiles: | CC1CCc2c(c(NC(c3ccc(cc3)S(N3CCc4ccccc34)(=O)=O)=O)sc2C1)c1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2145 |
| logD: | 7.051 |
| logSw: | -5.806 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.012 |
| InChI Key: | KSLCGXIVUSJFLO-LJQANCHMSA-N |