2-[(4-methyl-3-phenyl-3H-1,5-benzodiazepin-2-yl)amino]-2-oxoethyl 4-methylpiperazine-1-carbodithioate
Chemical Structure Depiction of
2-[(4-methyl-3-phenyl-3H-1,5-benzodiazepin-2-yl)amino]-2-oxoethyl 4-methylpiperazine-1-carbodithioate
2-[(4-methyl-3-phenyl-3H-1,5-benzodiazepin-2-yl)amino]-2-oxoethyl 4-methylpiperazine-1-carbodithioate
Compound characteristics
| Compound ID: | 6173-0354 |
| Compound Name: | 2-[(4-methyl-3-phenyl-3H-1,5-benzodiazepin-2-yl)amino]-2-oxoethyl 4-methylpiperazine-1-carbodithioate |
| Molecular Weight: | 465.64 |
| Molecular Formula: | C24 H27 N5 O S2 |
| Smiles: | CC1C(C(NC(CSC(N2CCN(C)CC2)=S)=O)=Nc2ccccc2N=1)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1211 |
| logD: | 2.3162 |
| logSw: | -3.3486 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.627 |
| InChI Key: | VBGKZBXJQMLQMT-JOCHJYFZSA-N |