N-(3-methylphenyl)-4-[1-(prop-2-en-1-yl)-1H-indole-5-sulfonyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(3-methylphenyl)-4-[1-(prop-2-en-1-yl)-1H-indole-5-sulfonyl]-1,4-diazepane-1-carboxamide
N-(3-methylphenyl)-4-[1-(prop-2-en-1-yl)-1H-indole-5-sulfonyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | G589-0649 |
| Compound Name: | N-(3-methylphenyl)-4-[1-(prop-2-en-1-yl)-1H-indole-5-sulfonyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C24 H28 N4 O3 S |
| Smiles: | Cc1cccc(c1)NC(N1CCCN(CC1)S(c1ccc2c(ccn2CC=C)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8198 |
| logD: | 3.8198 |
| logSw: | -3.7593 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.646 |
| InChI Key: | XKECIVYEYRHHHK-UHFFFAOYSA-N |