(4-{[1-(4-tert-butylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetic acid
Chemical Structure Depiction of
(4-{[1-(4-tert-butylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetic acid
(4-{[1-(4-tert-butylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetic acid
Compound characteristics
| Compound ID: | 2897-1539 |
| Compound Name: | (4-{[1-(4-tert-butylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetic acid |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C24 H24 N2 O6 S |
| Smiles: | CC(C)(C)c1ccc(cc1)N1C(C(=C\c2ccc(c(c2)OC)OCC(O)=O)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6264 |
| logD: | -0.6106 |
| logSw: | -4.0307 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.828 |
| InChI Key: | MVPSIEZLMATENJ-UHFFFAOYSA-N |