Basic information
- CAS
65322-72-7- Standard SMILES
CS(=O)(=O)O.NNc1cc2c(nn1)CCN(C(=O)c1ccccc1)C2- InChIKey
HMVROCAATOPFHB-UHFFFAOYSA-N- Molecular formula
- C15H19N5O4S
- Average molar mass
- 365.4 g/mol
- Monoisotopic mass
- 365.11577528
Overview
See also: Endralazine (has active moiety).
Names & identifiers
- Preferred name
- Endralazine Mesylate
- IUPAC
- (3-hydrazinyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl)-phenylmethanone;methanesulfonic acid
- English name
- Endralazine
- Molecular formula
- C15H19N5O4S
- Molecular weight
- 365.40746
Names & synonyms
ENDRALAZINE MESYLATEEndralazine mesilateEndralazine methanesulfonate65322-72-7Endralazine mesylate [USAN]NSC 310289NSC-310289UNII-333M5986I5Endralazine mesylate (USAN)Endralazine monomethanesulfonate333M5986I5DTXSID70215664
Show more names
ENDRALAZINE MESILATE [MART.]ENDRALAZINE MESILATE [WHO-DD]ENDRALAZINE METHANESULFONATE [MI]Pyrido(4,3-c)pyridazin-3(2H)-one, 6-benzoyl-5,6,7,8-tetrahydro-, hydrazone, monomethanesulfonateENDRALAZINE MESILATE (MART.)RefChem:136811DTXCID0013815522-708
Database identifiers
- CAS
65322-72-7- PubChem CID
- 47607
- DTXSID
DTXSID70215664- ChEMBL
CHEMBL1980706- UNII
- 333M5986I5
Properties
Computed structural properties
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 437
Physicochemical properties
- Melting point
- 185 · 185-188° (dec)
- FDA UNII
- 333 M5986I5 · 333M5986I5
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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