N-[11-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-2-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[11-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-2-yl]thiophene-2-carboxamide
N-[11-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-2-yl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V025-2587 |
| Compound Name: | N-[11-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-2-yl]thiophene-2-carboxamide |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C22 H19 N3 O2 S |
| Salt: | not_available |
| Smiles: | C1CCN(C1)C1c2cc(ccc2Oc2ccccc2N=1)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6297 |
| logD: | 4.4267 |
| logSw: | -4.5874 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.737 |
| InChI Key: | OVRPCBMZYSMSRR-UHFFFAOYSA-N |