methyl 4-{[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]amino}benzoate
methyl 4-{[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | C137-2264 |
| Compound Name: | methyl 4-{[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]amino}benzoate |
| Molecular Weight: | 479.35 |
| Molecular Formula: | C20 H19 Br N2 O5 S |
| Smiles: | COC(c1ccc(cc1)NS(c1cc2c(CCN2C(C2CC2)=O)cc1[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9276 |
| logD: | 3.3434 |
| logSw: | -4.1678 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.264 |
| InChI Key: | YYFFHPYPOJEOGL-UHFFFAOYSA-N |