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Chemical ID: 6876159

Cc1ccc(c(c1)NC(=O)COc2ccc(cc2)C(=O)Nc3ccccc3OC)C

Chemical ID:

6876159

Name [?]:

4-[(2,5-dimethylphenyl)carbamoylmethoxy]-N-(2-methoxyphenyl)-benzamide

SMILES [?]:

Cc1ccc(c(c1)NC(=O)COc2ccc(cc2)C(=O)Nc3ccccc3OC)C

InChi [?]:

InChI=1/C24H24N2O4/c1-16-8-9-17(2)21(14-16)25-23(27)15-30-19-12-10-18(11-13-19)24(28)26-20-6-4-5-7-22(20)29-3/h4-14H,15H2,1-3H3,(H,25,27)(H,26,28)

InChi Info:

AuxInfo=1/1/N:1,30,29,24,25,23,26,3,4,15,17,14,18,7,11,2,5,16,13,22,6,27,9,19,8,21,10,20,28,12/E:(10,11)(12,13)/rA:30nCCCCCCCNCOCOCCCCCCCONCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;s13;d14;s15;d16;d13s17;s16;d19;s19;s21;s22;d23;s24;d25;d22s26;s27;s28;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₂₄N₂O₄
All Atoms:	54
Heavy Atoms:	30
Chiral Atoms:	0

ZAP Information [?]

Total:	10.2508
Area:	653.658
Solvation:	-6.09062
Coulombic:	-57.9185

Bond Count [?]

All:	32
Single:	21
Double:	11
Rotors:	9
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	404.458
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	4.22
LogP (Chemaxon):	3.96

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