N-(3-chloro-4-methoxyphenyl)-N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
N-(3-chloro-4-methoxyphenyl)-N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
Compound characteristics
| Compound ID: | G849-0101 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide |
| Molecular Weight: | 477.97 |
| Molecular Formula: | C22 H24 Cl N3 O5 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CCNS(c1ccc2c(CCN2C(C2CC2)=O)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1969 |
| logD: | 3.1948 |
| logSw: | -3.5192 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.82 |
| InChI Key: | QXBBMNQLLOBEHT-UHFFFAOYSA-N |