AH 7079
Basic information
- CAS
33440-58-3- Standard SMILES
COc1ccc2oc3ccc(-c4nn[nH]n4)cc3c(=O)c2c1- InChIKey
ALWLIOKDPPDELH-UHFFFAOYSA-N- Molecular formula
- C15H10N4O3
- Average molar mass
- 294.26 g/mol
- Monoisotopic mass
- 294.07529019
Overview
anti-allergy cpd used in treatment of allergic bronchial asthma & rhinitis; structure
Names & identifiers
- Preferred name
- AH 7079
- IUPAC
- 2-methoxy-7-(2H-tetrazol-5-yl)xanthen-9-one
Names & synonyms
33440-58-3AH 70799H-Xanthen-9-one, 2-methoxy-7-(1H-tetrazol-5-yl)-RefChem:1102437-Methoxy-2-(1H-tetrazol-5-yl)xanthen-9-one2-methoxy-7-(2H-tetrazol-5-yl)xanthen-9-one2-Methoxy-7-(2H-tetrazol-5-yl)-9H-xanthen-9-oneorb1698667SCHEMBL10452829DTXSID80955069AKOS040750210T29738
Database identifiers
- CAS
33440-58-3- PubChem CID
- 182525
- DTXSID
DTXSID80955069- Nikkaji
- J667.514J
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 90 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 435
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Compound notes
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