3-{[(4-methoxyphenyl)methyl]amino}-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-{[(4-methoxyphenyl)methyl]amino}-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-{[(4-methoxyphenyl)methyl]amino}-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0497 |
| Compound Name: | 3-{[(4-methoxyphenyl)methyl]amino}-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 495.55 |
| Molecular Formula: | C25 H25 N3 O6 S |
| Smiles: | COc1ccc(CNc2cc3c(cc2S(N2CCOCC2)(=O)=O)C(Nc2ccccc2O3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5103 |
| logD: | 3.442 |
| logSw: | -3.892 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.04 |
| InChI Key: | HWVONIFKHZCCPG-UHFFFAOYSA-N |