2,2-dimethyl-5-(3-methylthiophen-2-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Chemical Structure Depiction of
2,2-dimethyl-5-(3-methylthiophen-2-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
2,2-dimethyl-5-(3-methylthiophen-2-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Compound characteristics
| Compound ID: | 3277-0126 |
| Compound Name: | 2,2-dimethyl-5-(3-methylthiophen-2-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one |
| Molecular Weight: | 373.52 |
| Molecular Formula: | C24 H23 N O S |
| Smiles: | Cc1ccsc1C1C2=C(CC(C)(C)CC2=O)c2c(ccc3ccccc23)N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7951 |
| logD: | 5.7951 |
| logSw: | -6.876 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.9502 |
| InChI Key: | JQZKPSQIQWWCHN-JOCHJYFZSA-N |