| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2008 | 16 | Yes |
Popular Name: ethyl 4-oxo-3,4-dihydroquinazoline-2-carboxylate ethyl 4-oxo-3,4-dihydroquinazoli…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 29113-33-5 , [29113-33-5]
4-Oxo-3,4-dihydro-quinazoline-2-carboxylic acid ethyl ester
4-Quinazolone-2-carboxylic acid ethyl ester
Ethyl 3,4-dihydro-4-oxoquinazoline-2-carboxylate
Ethyl 4-hydroxy-2-quinazolinecarboxylate
ethyl 4-oxo-3,4-dihydro-2-quinazolinecarboxylate
Ethyl 4-quinazolone-2-carboxylate
Ethyl 4-quinazolone-2-carboxylate, 98%
ethyl4-oxo-3,4-dihydro-2-quinazolinecarboxylate
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.76 | 2.38 | -46.72 | 0 | 5 | -1 | 75 | 217.204 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.30 | 4.36 | -8.14 | 1 | 5 | 0 | 72 | 218.212 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 189 - 193 | Enamine Building Blocks |
| Melting_Point | 189-193? | Alfa-Aesar |
| Melting_Point | 189-193° | Alfa-Aesar |
| MP | 190 - 192 | Enamine Building Blocks |
| MP | 190...192 | Enamine Building Blocks |
| melting_point | 197 - 199 | KeyOrganics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.