3-(4-chlorobenzene-1-sulfonyl)-1-(3-ethoxypropyl)-2-imino-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Chemical Structure Depiction of
3-(4-chlorobenzene-1-sulfonyl)-1-(3-ethoxypropyl)-2-imino-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
3-(4-chlorobenzene-1-sulfonyl)-1-(3-ethoxypropyl)-2-imino-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Compound characteristics
| Compound ID: | 5611-1987 |
| Compound Name: | 3-(4-chlorobenzene-1-sulfonyl)-1-(3-ethoxypropyl)-2-imino-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one |
| Molecular Weight: | 472.95 |
| Molecular Formula: | C22 H21 Cl N4 O4 S |
| Smiles: | CCOCCCN1C2=C(C=C(C1=N)S(c1ccc(cc1)[Cl])(=O)=O)C(N1C=CC=CC1=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5356 |
| logD: | 2.3566 |
| logSw: | -3.3944 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.997 |
| InChI Key: | VNBUBFZEVWJSTR-UHFFFAOYSA-N |