Chemical ID: 7169520

Cc1c(cnn1C)NC(=O)c2cc(c(cc2Cl)Cl)S(=O)(=O)N(C)C
Chemical ID:
7169520
Name [?]:
2,4-dichloro-N-(1,5-dimethylpyrazol-4-yl)-5-(dimethylsulfamoyl)benzamide
SMILES [?]:
Cc1c(cnn1C)NC(=O)c2cc(c(cc2Cl)Cl)S(=O)(=O)N(C)C
InChi [?]:
InChI=1/C14H16Cl2N4O3S/c1-8-12(7-17-20(8)4)18-14(21)9-5-13(11(16)6-10(9)15)24(22,23)19(2)3/h5-7H,1-4H3,(H,18,21)
InChi Info:
AuxInfo=1/1/N:1,23,24,7,12,15,4,2,11,16,14,3,13,9,17,18,5,8,22,6,10,20,21,19/E:(2,3)(22,23)/CRV:24.6/rA:24nCCCCNNCNCOCCCCCCClClSOONCC/rB:s1;d2;s3;d4;s2s5;s6;s3;s8;d9;s9;s11;d12;s13;d14;d11s15;s16;s14;s13;d19;d19;s19;s22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H16Cl2N4O3S
All Atoms:40
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.40958
Area:548.452
Solvation:-4.30173
Coulombic:-29.8331
Bond Count [?]
All:25
Single:17
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:391.273
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.46
LogP (Chemaxon):0.9

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