Cinecromen hydrochloride
[1-[4-methyl-7-(morpholine-4-carbonylamino)-2-oxochromen-3-yl]-3-morpholin-4-ylpropan-2-yl] 3-(3,4,5-trimethoxyphenyl)prop-2-enoate;hydrochloride
Also Known As: Cinecromen hydrochloride|Tvx 2656|TVX-2656|[1-[4-methyl-7-(morpholine-4-carbonylamino)-2-oxo-chromen-3-yl]-3-morpholin-4-yl-propan-2-yl] (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate hydrochloride|[1-[4-methyl-7-(morpholine-4-carbonylamino)-2-oxochromen-3-yl]-3-morpholin-4-ylpropan-2-yl] 3-(3,4,5-trimethoxyphenyl)prop-2-enoate;hydrochloride
| Molecular Formula | C34H42ClN3O10 |
|---|---|
| Molecular Weight | 687.25586 g/mol |
| LogP | 3.91302 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 687.25586 |
| Monoisotopic Mass | 687.25586 |
| Heavy Atoms | 48 |
| Complexity | 1120.0 |
Chemical Identifiers
| CAS Number | 62885-98-7 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)NC(=O)N3CCOCC3)CC(CN4CCOCC4)OC(=O)C=CC5=CC(=C(C(=C5)OC)OC)OC.Cl |
| InChIKey | VYASFWMYUYWMLJ-UHFFFAOYSA-N |
Product Overview
Cinecromen hydrochloride (CAS 62885-98-7), with molecular formula C34H42ClN3O10 and molecular weight 687.25586 g/mol. IUPAC: [1-[4-methyl-7-(morpholine-4-carbonylamino)-2-oxochromen-3-yl]-3-morpholin-4-ylpropan-2-yl] 3-(3,4,5-trimethoxyphenyl)prop-2-enoate;hydrochloride.
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