Chemical ID: 7254833

Cc1ccc(o1)C(=O)Nc2nc(cs2)c3ccc(cc3)NC(=O)C
Chemical ID:
7254833
Name [?]:
N-[4-(4-acetamidophenyl)thiazol-2-yl]-5-methyl-furan-2-carboxamide
SMILES [?]:
Cc1ccc(o1)C(=O)Nc2nc(cs2)c3ccc(cc3)NC(=O)C
InChi [?]:
InChI=1/C17H15N3O3S/c1-10-3-8-15(23-10)16(22)20-17-19-14(9-24-17)12-4-6-13(7-5-12)18-11(2)21/h3-9H,1-2H3,(H,18,21)(H,19,20,22)
InChi Info:
AuxInfo=1/1/N:1,24,3,16,20,17,19,4,13,2,22,15,18,12,5,7,10,21,11,9,23,8,6,14/E:(4,5)(6,7)/rA:24nCCCCCOCONCNCCSCCCCCCNCOC/rB:s1;d2;s3;d4;s2s5;s5;d7;s7;s9;d10;s11;d12;s10s13;s12;s15;d16;s17;d18;d15s19;s18;s21;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H15N3O3S
All Atoms:39
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.1908
Area:559.596
Solvation:-3.79909
Coulombic:-54.5208
Bond Count [?]
All:26
Single:17
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:341.385
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.02
LogP (Chemaxon):2.73

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Descriptor Annotations

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