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Chemical ID: 6215793

Cc1c(nc(s1)NC(=O)c2ccc(cc2)C(=O)c3ccccc3)c4ccccc4

Chemical ID:

6215793

Name [?]:

4-benzoyl-N-(5-methyl-4-phenyl-thiazol-2-yl)-benzamide

SMILES [?]:

Cc1c(nc(s1)NC(=O)c2ccc(cc2)C(=O)c3ccccc3)c4ccccc4

InChi [?]:

InChI=1/C24H18N2O2S/c1-16-21(17-8-4-2-5-9-17)25-24(29-16)26-23(28)20-14-12-19(13-15-20)22(27)18-10-6-3-7-11-18/h2-15H,1H3,(H,25,26,28)

InChi Info:

AuxInfo=1/1/N:1,27,21,26,28,20,22,25,29,19,23,12,14,11,15,2,24,18,13,10,3,16,8,5,4,7,17,9,6/E:(4,5)(6,7)(8,9)(10,11)(12,13)(14,15)/rA:29nCCCNCSNCOCCCCCCCOCCCCCCCCCCCC/rB:s1;d2;s3;d4;s2s5;s5;s7;d8;s8;s10;d11;s12;d13;d10s14;s13;d16;s16;s18;d19;s20;d21;d18s22;s3;s24;d25;s26;d27;d24s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₁₈N₂O₂S
All Atoms:	29
Heavy Atoms:	29
Chiral Atoms:	0

ZAP Information [?]

Total:	12.5265
Area:	628.203
Solvation:	-3.1786
Coulombic:	-40.0976

Bond Count [?]

All:	32
Single:	19
Double:	13
Rotors:	6
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	398.478
H-Bond Donors:	1
H-Bond Acceptors:	3
XLogP:	5.23
LogP (Chemaxon):	5.66

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value