5-(3-methylthiophen-2-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Chemical Structure Depiction of
5-(3-methylthiophen-2-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
5-(3-methylthiophen-2-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Compound characteristics
| Compound ID: | 2268-1468 |
| Compound Name: | 5-(3-methylthiophen-2-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one |
| Molecular Weight: | 345.46 |
| Molecular Formula: | C22 H19 N O S |
| Smiles: | Cc1ccsc1C1C2=C(CCCC2=O)c2c(ccc3ccccc23)N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3614 |
| logD: | 5.3614 |
| logSw: | -6.5261 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.9502 |
| InChI Key: | GXPZIGAGBJAOMX-OAQYLSRUSA-N |