Basic information
- Standard SMILES
CS(=O)(=O)Nc1ccc(-c2nc(NC(=O)N(CCC3CCNCC3)CCC(c3ccccc3)c3ccccc3)sc2Cl)cc1.Cl- InChIKey
FTNVNRPDEKOHOH-UHFFFAOYSA-N- Molecular formula
- C33H39Cl2N5O3S2
- Average molar mass
- 688.7 g/mol
Names & identifiers
- Preferred name
- 3-(5-chloro-4-(4-(methylsulfonamido)phenyl)thiazol-2-yl)-1-(3,3-diphenylpropyl)-1-(2-(piperidin-4-yl)ethyl)urea HCl salt
- IUPAC
- 3-[5-chloro-4-[4-(methanesulfonamido)phenyl]-1,3-thiazol-2-yl]-1-(3,3-diphenylpropyl)-1-(2-piperidin-4-ylethyl)urea;hydrochloride
Names & synonyms
SCHEMBL3639715FTNVNRPDEKOHOH-UHFFFAOYSA-N3-(5-chloro-4-(4-(methylsulfonamido)phenyl)thiazol-2-yl)-1-(3,3-diphenylpropyl)-1-(2-(piperidin-4-yl)ethyl)urea HCl salt
Database identifiers
- PubChem CID
- 86628126
Properties
Computed structural properties
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 956
Related reactions
1 records
Compound notes
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