(11-propyldibenzo[b,f][1,4]thiazepin-8-yl){4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(11-propyldibenzo[b,f][1,4]thiazepin-8-yl){4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methanone
(11-propyldibenzo[b,f][1,4]thiazepin-8-yl){4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | C304-4774 |
| Compound Name: | (11-propyldibenzo[b,f][1,4]thiazepin-8-yl){4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methanone |
| Molecular Weight: | 545.7 |
| Molecular Formula: | C31 H35 N3 O4 S |
| Smiles: | CCCC1c2ccccc2Sc2ccc(cc2N=1)C(N1CCN(CC1)Cc1ccc(c(c1OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1361 |
| logD: | 4.9356 |
| logSw: | -4.8793 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.484 |
| InChI Key: | YBDXALMRHNYFHT-UHFFFAOYSA-N |