Basic information
- Standard SMILES
Cc1cc(-c2n[nH]c3c(Cl)c(NC(=O)N[C@H](C)c4ccccc4)ncc23)ccn1- InChIKey
XMGGASPTRINPCS-CYBMUJFWSA-N- Molecular formula
- C21H19ClN6O
- Average molar mass
- 406.9 g/mol
Names & identifiers
- Preferred name
- (R)-1-(7-chloro-3-(2-methylpyridin-4-yl)-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-phenylethyl)urea
- IUPAC
- 1-[7-chloro-3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-3-[(1R)-1-phenylethyl]urea
Names & synonyms
CHEMBL3663026SCHEMBL14908057XMGGASPTRINPCS-CYBMUJFWSA-NBDBM157730US9023865, 571(R)-1-(7-chloro-3-(2-methylpyridin-4-yl)-1H-pyrazolo[4,3-c]pyridin-6-yl)-3-(1-phenylethyl)urea
Database identifiers
- PubChem CID
- 89535972
- ChEMBL
CHEMBL3663026
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 95.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 559
Related reactions
1 records
Compound notes
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