6-(4-chlorobenzene-1-sulfonyl)-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]pyridazin-3(2H)-one
Chemical Structure Depiction of
6-(4-chlorobenzene-1-sulfonyl)-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]pyridazin-3(2H)-one
6-(4-chlorobenzene-1-sulfonyl)-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F809-0196 |
| Compound Name: | 6-(4-chlorobenzene-1-sulfonyl)-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]pyridazin-3(2H)-one |
| Molecular Weight: | 459.91 |
| Molecular Formula: | C21 H18 Cl N3 O5 S |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CN1C(C=CC(=N1)S(c1ccc(cc1)[Cl])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.672 |
| logD: | 2.672 |
| logSw: | -3.3576 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.112 |
| InChI Key: | RYIWBHHJDJGSJI-UHFFFAOYSA-N |