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Chemical ID: 6884205

Cc1ccc(c(c1)NC(=O)c2ccc(cc2)OCC(=O)Nc3ccc(c(c3)Cl)C)OC

Chemical ID:

6884205

Name [?]:

4-[(3-chloro-4-methyl-phenyl)carbamoylmethoxy]-N-(2-methoxy-5-methyl-phenyl)-benzamide

SMILES [?]:

Cc1ccc(c(c1)NC(=O)c2ccc(cc2)OCC(=O)Nc3ccc(c(c3)Cl)C)OC

InChi [?]:

InChI=1/C24H23ClN2O4/c1-15-4-11-22(30-3)21(12-15)27-24(29)17-6-9-19(10-7-17)31-14-23(28)26-18-8-5-16(2)20(25)13-18/h4-13H,14H2,1-3H3,(H,26,28)(H,27,29)

InChi Info:

AuxInfo=1/1/N:1,29,31,3,24,12,16,23,13,15,4,7,27,18,2,25,11,22,14,26,6,5,19,9,28,21,8,20,10,30,17/E:(6,7)(9,10)/rA:31nCCCCCCCNCOCCCCCCOCCONCCCCCCClCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;d12;s13;d14;d11s15;s14;s17;s18;d19;s19;s21;s22;d23;s24;d25;d22s26;s26;s25;s5;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₂₃ClN₂O₄
All Atoms:	54
Heavy Atoms:	31
Chiral Atoms:	0

ZAP Information [?]

Total:	11.129
Area:	687.147
Solvation:	-6.04963
Coulombic:	-58.0005

Bond Count [?]

All:	33
Single:	22
Double:	11
Rotors:	9
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	438.903
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	4.85
LogP (Chemaxon):	5.13

Name Annotations

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

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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

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