methyl 2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
Compound ID: | K284-1667 |
Compound Name: | methyl 2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-3-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
Molecular Weight: | 462.57 |
Molecular Formula: | C22 H30 N4 O5 S |
Smiles: | CCCCNC(CSC1=Nc2cc(ccc2C(N1CCN1CCOCC1)=O)C(=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 1.7618 |
logD: | 1.6982 |
logSw: | -2.642 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 83.399 |
InChI Key: | MKYDICWNGKQEBR-UHFFFAOYSA-N |