N-(4-acetylphenyl)-2-[(8-chloro-6-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-acetylphenyl)-2-[(8-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide
N-(4-acetylphenyl)-2-[(8-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | G071-0799 |
Compound Name: | N-(4-acetylphenyl)-2-[(8-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide |
Molecular Weight: | 488.97 |
Molecular Formula: | C21 H17 Cl N4 O4 S2 |
Smiles: | CC(c1ccc(cc1)NC(CSc1ncc2c(c3ccc(cc3N(C)S2(=O)=O)[Cl])n1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4724 |
logD: | 3.4722 |
logSw: | -3.9793 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.419 |
InChI Key: | SFSGWGXQMRZXFB-UHFFFAOYSA-N |