Chemical ID: 6610743

CCc1cccc(c1NC(=O)COC(=O)c2cc3ccccc3cc2OC)CC
Chemical ID:
6610743
Name [?]:
(2,6-diethylphenyl)carbamoylmethyl 3-methoxynaphthalene-2-carboxylate
SMILES [?]:
CCc1cccc(c1NC(=O)COC(=O)c2cc3ccccc3cc2OC)CC
InChi [?]:
InChI=1/C24H25NO4/c1-4-16-11-8-12-17(5-2)23(16)25-22(26)15-29-24(27)20-13-18-9-6-7-10-19(18)14-21(20)28-3/h6-14H,4-5,15H2,1-3H3,(H,25,26)
InChi Info:
AuxInfo=1/1/N:1,29,27,2,28,20,21,5,19,22,4,6,17,24,12,3,7,18,23,16,25,10,8,14,9,11,15,26,13/E:(1,2)(4,5)(11,12)(16,17)/rA:29nCCCCCCCCNCOCOCOCCCCCCCCCCOCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;d14;s14;s16;d17;s18;d19;s20;d21;s18s22;d23;d16s24;s25;s26;s7;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H25NO4
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:10.755
Area:630.925
Solvation:-5.01811
Coulombic:-48.9831
Bond Count [?]
All:31
Single:21
Double:10
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:391.46
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.26
LogP (Chemaxon):3.85

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Descriptor Annotations

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