Chemical ID: 7155845

Cc1csc(n1)NC(=O)c2ccc3c4c2cccc4CC3
Chemical ID:
7155845
Name [?]:
N-(4-methylthiazol-2-yl)acenaphthene-5-carboxamide
SMILES [?]:
Cc1csc(n1)NC(=O)c2ccc3c4c2cccc4CC3
InChi [?]:
InChI=1/C17H14N2OS/c1-10-9-21-17(18-10)19-16(20)14-8-7-12-6-5-11-3-2-4-13(14)15(11)12/h2-4,7-9H,5-6H2,1H3,(H,18,19,20)
InChi Info:
AuxInfo=1/1/N:1,17,18,16,20,21,12,11,3,2,19,13,15,10,14,8,5,6,7,9,4/rA:21nCCCSCNNCOCCCCCCCCCCCC/rB:s1;d2;s3;s4;s2d5;s5;s7;d8;s8;s10;d11;s12;d13;d10s14;s15;d16;s17;s14d18;s19;s13s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14N2OS
All Atoms:35
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.46833
Area:464.823
Solvation:-2.15223
Coulombic:-27.9583
Bond Count [?]
All:24
Single:16
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:294.372
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.7
LogP (Chemaxon):3.97

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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