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Chemical ID: 4269041
Chemical ID:
4269041
Name [?]:
N-(9-ethylcarbazol-3-yl)-2-(4-methylphenoxy)-acetamide
SMILES [?]:
CCn1c2ccccc2c3c1ccc(c3)NC(=O)COc4ccc(cc4)C
InChi [?]:
InChI=1/C23H22N2O2/c1-3-25-21-7-5-4-6-19(21)20-14-17(10-13-22(20)25)24-23(26)15-27-18-11-8-16(2)9-12-18/h4-14H,3,15H2,1-2H3,(H,24,26)
InChi Info:
AuxInfo=1/1/N:1,27,2,7,6,8,5,23,25,13,22,26,12,15,19,24,14,21,9,10,4,11,17,16,3,18,20/E:(8,9)(11,12)/rA:27nCCNCCCCCCCCCCCCNCOCOCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s3s10;d11;s12;d13;d10s14;s14;s16;d17;s17;s19;s20;s21;d22;s23;d24;d21s25;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C23H22N2O2 |
All Atoms: | 27 |
Heavy Atoms: | 27 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.1275 |
Area: | 589.439 |
Solvation: | -4.60849 |
Coulombic: | -35.2389 |
Bond Count [?]
All: | 30 |
Single: | 20 |
Double: | 10 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 358.433 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 5.35 |
LogP (Chemaxon): | 5.73 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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