3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | K892-0349 |
Compound Name: | 3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
Molecular Weight: | 504.01 |
Molecular Formula: | C23 H26 Cl N5 O4 S |
Smiles: | Cc1ccc(cc1[Cl])NC(CN1C=Nc2c(C1=O)c(C)c(C(NCCN1CCOCC1)=O)s2)=O |
Stereo: | ACHIRAL |
logP: | 2.4623 |
logD: | 2.4337 |
logSw: | -3.498 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.536 |
InChI Key: | NRSLCMHKXQYGBL-UHFFFAOYSA-N |