N-(adamantan-1-yl)-4-(1-methyl-1H-indole-5-sulfonyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-(1-methyl-1H-indole-5-sulfonyl)-1,4-diazepane-1-carboxamide
N-(adamantan-1-yl)-4-(1-methyl-1H-indole-5-sulfonyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | G589-0508 |
| Compound Name: | N-(adamantan-1-yl)-4-(1-methyl-1H-indole-5-sulfonyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 470.63 |
| Molecular Formula: | C25 H34 N4 O3 S |
| Smiles: | Cn1ccc2cc(ccc12)S(N1CCCN(CC1)C(NC12CC3CC(CC(C3)C2)C1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9616 |
| logD: | 3.9609 |
| logSw: | -4.0105 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.242 |
| InChI Key: | JSSYSCDMDZJWEE-UHFFFAOYSA-N |