Basic information
- CAS
17692-56-7- Standard SMILES
Cc1cc(=O)oc2cc(OCCN3CCOCC3)cc(OCCN3CCOCC3)c12- InChIKey
KHVVROKBGPRWFA-UHFFFAOYSA-N- Molecular formula
- C22H30N2O6
- Average molar mass
- 418.5 g/mol
- Monoisotopic mass
- 418.21038668
Overview
Moxicoumone is a small molecule drug. Moxicoumone has a monoisotopic molecular weight of 418.21 Da.
Names & identifiers
- Preferred name
- 4-Methyl-5,7-bis(2-(4-morpholinyl)ethoxy)-2H-1-benzopyran-2-one
- IUPAC
- 4-methyl-5,7-bis(2-morpholin-4-ylethoxy)chromen-2-one
- English name
- Moxicoumone
- Molecular formula
- C22H30N2O6
- Molecular weight
- 418.48
Names & synonyms
Moxicoumone17692-56-7MoxicumonaMossicoumoneMoxicoumonumIG2442S013DTXSID901702214-methyl-5,7-bis-beta-N-morpholinoethoxycoumarinRefChem:912674DTXCID80927124-Methyl-5,7-bis(2-(4-morpholinyl)ethoxy)-2H-1-benzopyran-2-one4-Methyl-5,7-bis(2-morpholinoethoxy)-2H-chromen-2-one
Show more names
4-Methyl-5,7-bis(2-morpholinoethoxy)coumarin2H-1-Benzopyran-2-one, 4-methyl-5,7-bis[2-(4-morpholinyl)ethoxy]-
Moxicoumone [INN]4-methyl-5,7-bis(2-morpholin-4-ylethoxy)chromen-2-one4-Methyl-5,7-bis(2-morpholinoethylethoxy)coumarinMoxicumonumMoxicoumonum [INN-Latin]Mossicoumone [DCIT]Moxicumona [INN-Spanish]UNII-IG2442S013
Database identifiers
- CAS
17692-56-7- PubChem CID
- 65686
- DTXSID
DTXSID90170221- ChEMBL
CHEMBL2105164- UNII
- IG2442S013
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 588
Physicochemical properties
- Melting point
- 130 · 130-133 °C(Solv: methanol (67-56-1))
- Boiling point
- 603.8 · 603.8±55.0 °C(Predicted)
- Density
- 1.212 · 1.212±0.06 g/cm3(Predicted)
- pka
- 6.24 · 6.24±0.10(Predicted)
- FDA UNII
- 2442 S013 · IG2442S013
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationAgents that prevent BLOOD CLOTTING.
Applications
UsesMoxicoumone is an anticoagulant[1].
Suppliers5 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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