Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)NC(=O)Nc2cccc(-c3nn4c(c3-c3ccncc3)SCCC4)c2)cc1- InChIKey
CYMWIPKNYXBVHS-UHFFFAOYSA-N- Molecular formula
- C25H23N5O3S2
- Average molar mass
- 505.6 g/mol
Names & identifiers
- Preferred name
- 1-(4-methyl-benzenesulfonyl)-3-[3-(3-pyridin-4-yl-6,7-dihydro-5H-pyrazolo-[5,1-b][1,3]thiazin-2-yl)-phenyl]-urea
- IUPAC
- 1-(4-methylphenyl)sulfonyl-3-[3-(3-pyridin-4-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-2-yl)phenyl]urea
Names & synonyms
SCHEMBL2477817CYMWIPKNYXBVHS-UHFFFAOYSA-N1-(4-methyl-benzenesulfonyl)-3-[3-(3-pyridin-4-yl-6,7-dihydro-5H-pyrazolo-[5,1-b][1,3]thiazin-2-yl)-phenyl]-urea
Database identifiers
- PubChem CID
- 58477105
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 823
Related reactions
2 records
Compound notes
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