3-(3,4-dimethylphenoxy)-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-(3,4-dimethylphenoxy)-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-(3,4-dimethylphenoxy)-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0430 |
| Compound Name: | 3-(3,4-dimethylphenoxy)-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C25 H24 N2 O5 S |
| Smiles: | Cc1ccc(cc1C)Oc1cc2c(cc1S(N1CCCC1)(=O)=O)C(Nc1ccccc1O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3992 |
| logD: | 5.3767 |
| logSw: | -5.2806 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.251 |
| InChI Key: | SPWMTCMTAYEBBN-UHFFFAOYSA-N |