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Chemical ID: 4081764
Chemical ID:
4081764
Name [?]:
N-(9-ethylcarbazol-3-yl)naphthalene-2-carboxamide
SMILES [?]:
CCn1c2ccccc2c3c1ccc(c3)NC(=O)c4ccc5ccccc5c4
InChi [?]:
InChI=1/C25H20N2O/c1-2-27-23-10-6-5-9-21(23)22-16-20(13-14-24(22)27)26-25(28)19-12-11-17-7-3-4-8-18(17)15-19/h3-16H,2H2,1H3,(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,2,24,25,7,6,23,26,8,5,21,20,13,12,28,15,22,27,19,14,9,10,4,11,17,16,3,18/rA:28nCCNCCCCCCCCCCCCNCOCCCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s3s10;d11;s12;d13;d10s14;s14;s16;d17;s17;s19;d20;s21;s22;d23;s24;d25;d22s26;d19s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C25H20N2O |
All Atoms: | 28 |
Heavy Atoms: | 28 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 11.9872 |
Area: | 582.896 |
Solvation: | -2.58522 |
Coulombic: | -30.5783 |
Bond Count [?]
All: | 32 |
Single: | 20 |
Double: | 12 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 364.439 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 6.49 |
LogP (Chemaxon): | 6.49 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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