4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-N-(propan-2-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-N-(propan-2-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-N-(propan-2-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | K284-1561 |
Compound Name: | 4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-N-(propan-2-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
Molecular Weight: | 388.49 |
Molecular Formula: | C19 H24 N4 O3 S |
Smiles: | CC(C)NC(c1ccc2C(N(CCCN3CCCC3=O)C(Nc2c1)=S)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.0354 |
logD: | 1.0327 |
logSw: | -2.4907 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.468 |
InChI Key: | DMLRSDWATPEAFH-UHFFFAOYSA-N |