Chemical ID: 5526929

CC(C)(C)c1ccc(cc1)NC(=O)c2cccs2
Chemical ID:
5526929
Name [?]:
N-(4-tert-butylphenyl)thiophene-2-carboxamide
SMILES [?]:
CC(C)(C)c1ccc(cc1)NC(=O)c2cccs2
InChi [?]:
InChI=1/C15H17NOS/c1-15(2,3)11-6-8-12(9-7-11)16-14(17)13-5-4-10-18-13/h4-10H,1-3H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,3,4,16,15,6,10,7,9,17,5,8,14,12,2,11,13,18/E:(1,2,3)(6,7)(8,9)/rA:18nCCCCCCCCCCNCOCCCCS/rB:s1;s2;s2;s2;s5;d6;s7;d8;d5s9;s8;s11;d12;s12;d14;s15;d16;s14s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H17NOS
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.85976
Area:455.69
Solvation:-1.53249
Coulombic:-24.4245
Bond Count [?]
All:19
Single:13
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:259.368
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.84
LogP (Chemaxon):4.15

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