N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-[(4-methylpyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-[(4-methylpyrimidin-2-yl)sulfanyl]acetamide
N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-[(4-methylpyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G943-0561 |
| Compound Name: | N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-2-[(4-methylpyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C23 H20 N4 O2 S2 |
| Smiles: | Cc1ccnc(n1)SCC(Nc1ccc2c(c1)Sc1ccccc1C(N2C1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3973 |
| logD: | 4.3973 |
| logSw: | -4.3394 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.363 |
| InChI Key: | JJOZQAKEMNNBFU-UHFFFAOYSA-N |