N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-methyl-4-[(3-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-methyl-4-[(3-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-methyl-4-[(3-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | M385-0960 |
| Compound Name: | N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-methyl-4-[(3-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 436.6 |
| Molecular Formula: | C26 H36 N4 O2 |
| Smiles: | CCN1CCN(CCNC(c2ccc3c(c2)N(Cc2cccc(C)c2)C(C)CO3)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2855 |
| logD: | 2.4929 |
| logSw: | -3.3898 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.129 |
| InChI Key: | QSMOJRSXTBXZLA-NRFANRHFSA-N |