Chemical ID: 7325339

Cc1ccc(cc1)c2nnc(o2)SCC(=O)NC(=O)NC(C)C
Chemical ID:
7325339
Name [?]:
N-(isopropylcarbamoyl)-2-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
SMILES [?]:
Cc1ccc(cc1)c2nnc(o2)SCC(=O)NC(=O)NC(C)C
InChi [?]:
InChI=1/C15H18N4O3S/c1-9(2)16-14(21)17-12(20)8-23-15-19-18-13(22-15)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3,(H2,16,17,20,21)
InChi Info:
AuxInfo=1/1/N:22,23,1,3,7,4,6,14,21,2,5,15,8,18,11,20,17,9,10,16,19,12,13/E:(1,2)(4,5)(6,7)/rA:23nCCCCCCCCNNCOSCCONCONCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s9;d10;s8s11;s11;s13;s14;d15;s15;s17;d18;s18;s20;s21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H18N4O3S
All Atoms:41
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.82875
Area:565.198
Solvation:-4.30121
Coulombic:-56.5763
Bond Count [?]
All:24
Single:17
Double:7
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:334.395
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.96
LogP (Chemaxon):2.02

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Descriptor Annotations

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