N-(2,2-dimethoxyethyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(2,2-dimethoxyethyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-(2,2-dimethoxyethyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-1581 |
| Compound Name: | N-(2,2-dimethoxyethyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 434.51 |
| Molecular Formula: | C20 H26 N4 O5 S |
| Smiles: | COC(CNC(c1ccc2C(N(CCCN3CCCC3=O)C(Nc2c1)=S)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | -0.0699 |
| logD: | -0.0726 |
| logSw: | -2.4283 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.988 |
| InChI Key: | KKDQUYMHPSAPDQ-UHFFFAOYSA-N |