N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-(3,4,5-trimethoxyphenyl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-(3,4,5-trimethoxyphenyl)-beta-alaninamide
N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-(3,4,5-trimethoxyphenyl)-beta-alaninamide
Compound characteristics
| Compound ID: | G849-0057 |
| Compound Name: | N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-(3,4,5-trimethoxyphenyl)-beta-alaninamide |
| Molecular Weight: | 503.57 |
| Molecular Formula: | C24 H29 N3 O7 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CCNS(c1ccc2c(CCN2C(C2CC2)=O)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0669 |
| logD: | 2.0643 |
| logSw: | -3.0625 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.167 |
| InChI Key: | FZHQEZUVSZQJLY-UHFFFAOYSA-N |