8-(4-benzylpiperazine-1-sulfonyl)-2-ethyl-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-1-one
Chemical Structure Depiction of
8-(4-benzylpiperazine-1-sulfonyl)-2-ethyl-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-1-one
8-(4-benzylpiperazine-1-sulfonyl)-2-ethyl-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | P896-0535 |
| Compound Name: | 8-(4-benzylpiperazine-1-sulfonyl)-2-ethyl-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepin-1-one |
| Molecular Weight: | 416.54 |
| Molecular Formula: | C21 H28 N4 O3 S |
| Smiles: | CCN1CCCn2cc(cc2C1=O)S(N1CCN(CC1)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6307 |
| logD: | 1.6238 |
| logSw: | -2.3859 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.557 |
| InChI Key: | JYKSIDFHBIRRBT-UHFFFAOYSA-N |