3-[(furan-2-yl)methyl]-2-[(prop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Chemical Structure Depiction of
3-[(furan-2-yl)methyl]-2-[(prop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
3-[(furan-2-yl)methyl]-2-[(prop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Compound characteristics
| Compound ID: | 5218-3270 |
| Compound Name: | 3-[(furan-2-yl)methyl]-2-[(prop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C25 H26 N2 O2 S |
| Smiles: | C=CCSC1=NC2=C(C(N1Cc1ccco1)=O)C1(CCCCC1)Cc1ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.7886 |
| logD: | 5.7886 |
| logSw: | -5.7034 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.569 |
| InChI Key: | XQWQHMRTCZWSIO-UHFFFAOYSA-N |