2-(butylsulfanyl)-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-(butylsulfanyl)-5,6,7,8-tetrahydroquinazolin-4(3H)-one
2-(butylsulfanyl)-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | D467-0108 |
| Compound Name: | 2-(butylsulfanyl)-5,6,7,8-tetrahydroquinazolin-4(3H)-one |
| Molecular Weight: | 238.35 |
| Molecular Formula: | C12 H18 N2 O S |
| Smiles: | CCCCSC1NC(C2CCCCC=2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9154 |
| logD: | 2.694 |
| logSw: | -3.1617 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.743 |
| InChI Key: | YJVTWMHDJWNUCF-UHFFFAOYSA-N |