3-methyl-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Chemical Structure Depiction of
3-methyl-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
3-methyl-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Compound characteristics
| Compound ID: | 8009-2413 |
| Compound Name: | 3-methyl-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one |
| Molecular Weight: | 402.56 |
| Molecular Formula: | C25 H26 N2 O S |
| Smiles: | CN1C(=NC2=C(C1=O)C1(CCCC1)Cc1ccccc12)SCCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4153 |
| logD: | 5.4153 |
| logSw: | -5.3505 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.9523 |
| InChI Key: | HXNWIOIJTCQNRT-UHFFFAOYSA-N |