6-methyl-4-{4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-oxobutyl}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-methyl-4-{4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-oxobutyl}-2H-1,4-benzoxazin-3(4H)-one
6-methyl-4-{4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-oxobutyl}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C798-0288 |
| Compound Name: | 6-methyl-4-{4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-oxobutyl}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)C(CCCN1C(COc2ccc(C)cc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.228 |
| logD: | 3.2279 |
| logSw: | -3.376 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.918 |
| InChI Key: | RSMWCLVNUCSYGO-FQEVSTJZSA-N |