2-benzyl-8-(5-methylthiophene-2-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-benzyl-8-(5-methylthiophene-2-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-benzyl-8-(5-methylthiophene-2-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0335 |
| Compound Name: | 2-benzyl-8-(5-methylthiophene-2-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C21 H25 N3 O2 S |
| Smiles: | Cc1ccc(C(N2CCC3C(N(CCN3CC2)Cc2ccccc2)=O)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6969 |
| logD: | 2.6954 |
| logSw: | -2.7252 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.821 |
| InChI Key: | WTGUAFHBHDELIR-GOSISDBHSA-N |