3-{[(4-methoxyphenyl)methyl]amino}-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-{[(4-methoxyphenyl)methyl]amino}-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-{[(4-methoxyphenyl)methyl]amino}-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0546 |
| Compound Name: | 3-{[(4-methoxyphenyl)methyl]amino}-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 507.61 |
| Molecular Formula: | C27 H29 N3 O5 S |
| Smiles: | CC1CCN(CC1)S(c1cc2C(Nc3ccccc3Oc2cc1NCc1ccc(cc1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9738 |
| logD: | 4.9055 |
| logSw: | -4.5564 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.132 |
| InChI Key: | CYSNULGTBKOTEP-UHFFFAOYSA-N |