General Information of the Compound
Compound ID
CP0157310
Compound Name
N-[[4-(2,4-dimethylimidazol-1-yl)phenyl]methyl]-2,5-difluorobenzenesulfonamide
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Structure
Formula
C18H17F2N3O2S
Molecular Weight
377.416
Canonical SMILES
Cc1cn(c(C)n1)-c1ccc(CNS(=O)(=O)c2cc(F)ccc2F)cc1
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InChI
InChI=1S/C18H17F2N3O2S/c1-12-11-23(13(2)22-12)16-6-3-14(4-7-16)10-21-26(24,25)18-9-15(19)5-8-17(18)20/h3-9,11,21H,10H2,1-2H3
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InChIKey
RBPRPTLMEWSCMU-UHFFFAOYSA-N
Physicochemical Property
logP
3.24584
Rotatable Bonds
5
Heavy Atom Count
26
Polar Areas
63.99
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Complexity
26

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 72544603
ChEMBL ID
CHEMBL3086027