1-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-3-(pyrrolidine-1-sulfonyl)pyridin-2(1H)-one
Chemical Structure Depiction of
1-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-3-(pyrrolidine-1-sulfonyl)pyridin-2(1H)-one
1-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-3-(pyrrolidine-1-sulfonyl)pyridin-2(1H)-one
Compound characteristics
| Compound ID: | P158-0807 |
| Compound Name: | 1-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-3-(pyrrolidine-1-sulfonyl)pyridin-2(1H)-one |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CN1C=CC=C(C1=O)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1698 |
| logD: | 1.1698 |
| logSw: | -2.4136 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.038 |
| InChI Key: | WPXHBKMRJSZWDH-UHFFFAOYSA-N |