N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]thiophene-2-carboxamide
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | J031-1001 |
| Compound Name: | N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]thiophene-2-carboxamide |
| Molecular Weight: | 317.4 |
| Molecular Formula: | C17 H19 N O3 S |
| Smiles: | CCC(c1ccc2c(c1)OCCCO2)NC(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1398 |
| logD: | 3.1398 |
| logSw: | -3.3066 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.455 |
| InChI Key: | NOHROYUMAVAXAX-ZDUSSCGKSA-N |