Chemical ID: 6148868

c1ccc(cc1)C(=O)Nc2ccc(cc2)c3csc(n3)Nc4ccccc4
Chemical ID:
6148868
Name [?]:
N-[4-(2-anilinothiazol-4-yl)phenyl]benzamide
SMILES [?]:
c1ccc(cc1)C(=O)Nc2ccc(cc2)c3csc(n3)Nc4ccccc4
InChi [?]:
InChI=1/C22H17N3OS/c26-21(17-7-3-1-4-8-17)23-19-13-11-16(12-14-19)20-15-27-22(25-20)24-18-9-5-2-6-10-18/h1-15H,(H,23,26)(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,25,2,6,24,26,3,5,23,27,12,14,11,15,17,13,4,22,10,16,7,19,9,21,20,8,18/E:(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)/rA:27nCCCCCCCONCCCCCCCCSCNNCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;d7;s7;s9;s10;d11;s12;d13;d10s14;s13;d16;s17;s18;s16d19;s19;s21;s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H17N3OS
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:12.173
Area:597.69
Solvation:-2.76924
Coulombic:-42.1391
Bond Count [?]
All:30
Single:18
Double:12
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:371.456
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:5.04
LogP (Chemaxon):5.7

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Descriptor Annotations

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