5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3703-0368 |
| Compound Name: | 5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 492.35 |
| Molecular Formula: | C20 H18 Br N3 O5 S |
| Smiles: | COc1ccc(cc1)N1C(C(=C\c2cc(c(N3CCOCC3)o2)[Br])\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5306 |
| logD: | 2.1444 |
| logSw: | -3.0644 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.514 |
| InChI Key: | BQPVUZGGZSKKTM-UHFFFAOYSA-N |