Chemical ID: 7317731

CCc1ccc(cc1)c2csc(n2)NC(=O)CCNC(=O)c3ccco3
Chemical ID:
7317731
Name [?]:
N-[2-[[4-(4-ethylphenyl)thiazol-2-yl]carbamoyl]ethyl]furan-2-carboxamide
SMILES [?]:
CCc1ccc(cc1)c2csc(n2)NC(=O)CCNC(=O)c3ccco3
InChi [?]:
InChI=1/C19H19N3O3S/c1-2-13-5-7-14(8-6-13)15-12-26-19(21-15)22-17(23)9-10-20-18(24)16-4-3-11-25-16/h3-8,11-12H,2,9-10H2,1H3,(H,20,24)(H,21,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,24,23,4,8,5,7,17,18,25,10,3,6,9,22,15,20,12,19,13,14,16,21,26,11/E:(5,6)(7,8)/rA:26nCCCCCCCCCCSCNNCOCCNCOCCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s10;s11;s9d12;s12;s14;d15;s15;s17;s18;s19;d20;s20;d22;s23;d24;s22s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H19N3O3S
All Atoms:45
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.2334
Area:612.271
Solvation:-4.07338
Coulombic:-56.5321
Bond Count [?]
All:28
Single:19
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:369.439
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.76
LogP (Chemaxon):3.36

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