4-{2-[3-chloro-2,5-bis(4-methylphenyl)-1-benzoxepin-4(5H)-ylidene]ethyl}morpholine--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-{2-[3-chloro-2,5-bis(4-methylphenyl)-1-benzoxepin-4(5H)-ylidene]ethyl}morpholine--hydrogen chloride (1/1)
4-{2-[3-chloro-2,5-bis(4-methylphenyl)-1-benzoxepin-4(5H)-ylidene]ethyl}morpholine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 5973-0155 |
| Compound Name: | 4-{2-[3-chloro-2,5-bis(4-methylphenyl)-1-benzoxepin-4(5H)-ylidene]ethyl}morpholine--hydrogen chloride (1/1) |
| Molecular Weight: | 508.49 |
| Molecular Formula: | C30 H30 Cl N O2 |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1)C1/C(=C/CN2CCOCC2)C(=C(c2ccc(C)cc2)Oc2ccccc12)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2395 |
| logD: | 7.2383 |
| logSw: | -6.784 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 18.8102 |
| InChI Key: | AWZYJCACCRVSLW-ZJTZAHLKSA-N |