Chemical ID: 5820827

CC(c1cccs1)NC(=O)Cc2ccccc2
Chemical ID:
5820827
Name [?]:
2-phenyl-N-[1-(2-thienyl)ethyl]acetamide
SMILES [?]:
CC(c1cccs1)NC(=O)Cc2ccccc2
InChi [?]:
InChI=1/C14H15NOS/c1-11(13-8-5-9-17-13)15-14(16)10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,15,14,16,5,13,17,4,6,11,2,12,3,9,8,10,7/E:(3,4)(6,7)/rA:17cCCCCCCSNCOCCCCCCC/rB:s1;s2;d3;s4;d5;s3s6;s2;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H15NOS
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:8.88861
Area:445.236
Solvation:-2.24228
Coulombic:-23.0282
Bond Count [?]
All:18
Single:12
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:245.341
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.54
LogP (Chemaxon):2.66

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