Basic information
- CAS
34966-41-1- Standard SMILES
CCCCNc1c(C(=O)OCC)cnc2c1cnn2CC- InChIKey
IQNQAOGGWGCROX-UHFFFAOYSA-N- Molecular formula
- C15H22N4O2
- Average molar mass
- 290.36 g/mol
- Monoisotopic mass
- 290.17427596
Overview
Cartazolate is a small molecule drug. Cartazolate has a monoisotopic molecular weight of 290.17 Da.
Names & identifiers
- Preferred name
- Cartazolate
- IUPAC
- ethyl 4-(butylamino)-1-ethylpyrazolo[3,4-b]pyridine-5-carboxylate
- English name
- Cartazolate
- Molecular formula
- C15H22N4O2
- Molecular weight
- 290.36
Names & synonyms
CARTAZOLATE34966-41-1CartazolatoCartazolatumSQ 65396SQ-65396NSC-1668738K93Z46WPYDTXSID201885114-Butylamino-1-ethyl-lH-pyrazolo-(3,4-b)pyridine-5-carboxylic acid ethyl esterRefChem:918099DTXCID80111002
Show more names
1H-Pyrazolo[3,4-b]pyridine-5-carboxylic acid, 4-(butylamino)-1-ethyl-, ethyl ester
ethyl 4-(butylamino)-1-ethylpyrazolo[3,4-b]pyridine-5-carboxylateCHEMBL8184ethyl 4-(butylamino)-1-ethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate4-Butylamino-1-ethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl esterEthyl 4-(butylamino)-1-ethyl-1H-pyrazolo(3,4-b)-pyridine-5-carboxylateEthyl 4-(butylamino)-1-ethyl-1H-pyrazolo[3,4-b]-pyridine-5-carboxylate1H-Pyrazolo(3,4-b)pyridine-5-carboxylic acid, 4-(butylamino)-1-ethyl-, ethyl esterCartazolate [USAN:INN]
Database identifiers
- CAS
34966-41-1- PubChem CID
- 37015
- DTXSID
DTXSID20188511- ChEMBL
CHEMBL8184- UNII
- 8K93Z46WPY
- Nikkaji
- J19.429H
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 69 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 340
Physicochemical properties
- Boiling point
- 420.8 · 420.8±40.0 °C(Predicted)
- Density
- 1.19 · 1.19±0.1 g/cm3(Predicted)
- pka
- 4.09 · 4.09±0.10(Predicted)
- FDA UNII
- 8 K93Z46WPY · 8K93Z46WPY
Chemistry & industry
Applications
UsesAntidepressant.
Suppliers3 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海芮晖化工科技有限公司021-31433387 15618786686 · [email protected]
佛山合硕医药科技有限公司15363639686 · [email protected]
Related reactions
2 records
Compound notes
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