3-chloro-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-chloro-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-chloro-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0218 |
| Compound Name: | 3-chloro-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 378.83 |
| Molecular Formula: | C17 H15 Cl N2 O4 S |
| Smiles: | C1CCN(C1)S(c1cc2C(Nc3ccccc3Oc2cc1[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3495 |
| logD: | 3.0631 |
| logSw: | -3.9421 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.417 |
| InChI Key: | WRELXEZWZLXAIV-UHFFFAOYSA-N |