N-cyclohexyl-4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-cyclohexyl-4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-cyclohexyl-4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | A0060919 |
Compound Name: | N-cyclohexyl-4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
Molecular Weight: | 343.45 |
Molecular Formula: | C18 H21 N3 O2 S |
Smiles: | C=CCN1C(c2ccc(cc2NC1=S)C(NC1CCCCC1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2925 |
logD: | 3.2907 |
logSw: | -3.7131 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.707 |
InChI Key: | CYDOSJRNHQDQPW-UHFFFAOYSA-N |