Chemical ID: 7316387

c1ccc(cc1)c2ccccc2C(=O)NCc3cccs3
Chemical ID:
7316387
Name [?]:
2-phenyl-N-(2-thienylmethyl)benzamide
SMILES [?]:
c1ccc(cc1)c2ccccc2C(=O)NCc3cccs3
InChi [?]:
InChI=1/C18H15NOS/c20-18(19-13-15-9-6-12-21-15)17-11-5-4-10-16(17)14-7-2-1-3-8-14/h1-12H,13H2,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,9,10,19,3,5,18,8,11,20,16,4,17,7,12,13,15,14,21/E:(2,3)(7,8)/rA:21nCCCCCCCCCCCCCONCCCCCS/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;d7s11;s12;d13;s13;s15;s16;d17;s18;d19;s17s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H15NOS
All Atoms:36
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.2579
Area:495.46
Solvation:-2.12863
Coulombic:-25.7823
Bond Count [?]
All:23
Single:14
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:293.384
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.14
LogP (Chemaxon):3.82

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