Chemical ID: 5611373

c1cc(c(cc1c2csc(n2)NC(=O)c3ccc(c(c3)F)F)F)F
Chemical ID:
5611373
Name [?]:
N-[4-(3,4-difluorophenyl)thiazol-2-yl]-3,4-difluoro-benzamide
SMILES [?]:
c1cc(c(cc1c2csc(n2)NC(=O)c3ccc(c(c3)F)F)F)F
InChi [?]:
InChI=1/C16H8F4N2OS/c17-10-3-1-8(5-12(10)19)14-7-24-16(21-14)22-15(23)9-2-4-11(18)13(20)6-9/h1-7H,(H,21,22,23)
InChi Info:
AuxInfo=1/1/N:1,16,2,17,5,20,8,6,15,3,18,4,19,7,13,10,24,22,23,21,11,12,14,9/rA:24nCCCCCCCCSCNNCOCCCCCCFFFF/rB:s1;d2;s3;d4;d1s5;s6;d7;s8;s9;s7d10;s10;s12;d13;s13;s15;d16;s17;d18;d15s19;s19;s18;s4;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H8F4N2OS
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:6.4743
Area:505.276
Solvation:-6.1576
Coulombic:-41.2097
Bond Count [?]
All:26
Single:17
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:352.307
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.47
LogP (Chemaxon):5.0

Name Annotations

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Descriptor Annotations

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