N-(4-chloro-2-fluorophenyl)-2-({6-[(3-fluorophenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-2-({6-[(3-fluorophenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
N-(4-chloro-2-fluorophenyl)-2-({6-[(3-fluorophenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C200-5091 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-2-({6-[(3-fluorophenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 559.01 |
| Molecular Formula: | C25 H17 Cl F2 N4 O3 S2 |
| Smiles: | C(c1cccc(c1)F)N1c2ccccc2c2c(cnc(n2)SCC(Nc2ccc(cc2F)[Cl])=O)S1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.138 |
| logD: | 5.1302 |
| logSw: | -5.452 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.618 |
| InChI Key: | ONMGUIRMCDSZFO-UHFFFAOYSA-N |