N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-4-(pyridin-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-4-(pyridin-2-yl)piperazine-1-carboxamide
N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-4-(pyridin-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | E006-0036 |
| Compound Name: | N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-4-(pyridin-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C24 H23 N5 O2 S |
| Smiles: | CN1C(c2ccccc2Sc2ccc(cc12)NC(N1CCN(CC1)c1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0258 |
| logD: | 4.0169 |
| logSw: | -4.1862 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.679 |
| InChI Key: | SPWURNXMZAJUJC-UHFFFAOYSA-N |