5-[(thiomorpholin-4-yl)methyl]-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one
Chemical Structure Depiction of
5-[(thiomorpholin-4-yl)methyl]-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one
5-[(thiomorpholin-4-yl)methyl]-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one
Compound characteristics
| Compound ID: | Y043-3168 |
| Compound Name: | 5-[(thiomorpholin-4-yl)methyl]-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one |
| Molecular Weight: | 300.38 |
| Molecular Formula: | C15 H16 N4 O S |
| Smiles: | C1CSCCN1CN1C(c2cccc3c2c(C=N1)c[nH]3)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6472 |
| logD: | 1.6464 |
| logSw: | -2.6178 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.858 |
| InChI Key: | NHJVCQGKVIXORU-UHFFFAOYSA-N |