4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]butanamide
Chemical Structure Depiction of
4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]butanamide
4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]butanamide
Compound characteristics
| Compound ID: | E015-1135 |
| Compound Name: | 4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]butanamide |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C20 H29 N3 O3 |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CCC(NCCCN1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3315 |
| logD: | -1.759 |
| logSw: | -2.057 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.637 |
| InChI Key: | KVAUVAVQWXRKMI-UHFFFAOYSA-N |