N-[2-(cyclohex-1-en-1-yl)ethyl]-N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
Compound characteristics
| Compound ID: | G849-0004 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C23 H31 N3 O4 S |
| Smiles: | C1CCC(CCNC(CCNS(c2ccc3c(CCN3C(C3CC3)=O)c2)(=O)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.5318 |
| logD: | 2.5317 |
| logSw: | -2.9557 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.545 |
| InChI Key: | TZIMILYWXXRXIO-UHFFFAOYSA-N |