1'-ethyl-4-(thiophene-2-sulfonyl)-4,5-dihydro-3H-spiro[[1,4]benzoxazepine-2,4'-piperidine]
Chemical Structure Depiction of
1'-ethyl-4-(thiophene-2-sulfonyl)-4,5-dihydro-3H-spiro[[1,4]benzoxazepine-2,4'-piperidine]
1'-ethyl-4-(thiophene-2-sulfonyl)-4,5-dihydro-3H-spiro[[1,4]benzoxazepine-2,4'-piperidine]
Compound characteristics
| Compound ID: | CM3852-4522 |
| Compound Name: | 1'-ethyl-4-(thiophene-2-sulfonyl)-4,5-dihydro-3H-spiro[[1,4]benzoxazepine-2,4'-piperidine] |
| Molecular Weight: | 392.54 |
| Molecular Formula: | C19 H24 N2 O3 S2 |
| Smiles: | CCN1CCC2(CC1)CN(Cc1ccccc1O2)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1958 |
| logD: | 0.9003 |
| logSw: | -3.4621 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.246 |
| InChI Key: | ICFSALREUYMIJK-UHFFFAOYSA-N |