2-imino-10-methyl-3-(4-methylbenzene-1-sulfonyl)-1-pentyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Chemical Structure Depiction of
2-imino-10-methyl-3-(4-methylbenzene-1-sulfonyl)-1-pentyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
2-imino-10-methyl-3-(4-methylbenzene-1-sulfonyl)-1-pentyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Compound characteristics
Compound ID: | 5611-1994 |
Compound Name: | 2-imino-10-methyl-3-(4-methylbenzene-1-sulfonyl)-1-pentyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one |
Molecular Weight: | 450.56 |
Molecular Formula: | C24 H26 N4 O3 S |
Smiles: | CCCCCN1C2=C(C=C(C1=N)S(c1ccc(C)cc1)(=O)=O)C(N1C=CC=C(C)C1=N2)=O |
Stereo: | ACHIRAL |
logP: | 4.0477 |
logD: | 3.9363 |
logSw: | -3.8212 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.04 |
InChI Key: | KMPMRDFONAMFJJ-UHFFFAOYSA-N |