ChemDB: Chemical Search
Download
Chemical ID: 7533524
Chemical ID:
7533524
Name [?]:
N-phenyl-2-[(4-phenylthiazol-2-yl)carbamoylmethoxy]benzamide
SMILES [?]:
c1ccc(cc1)c2csc(n2)NC(=O)COc3ccccc3C(=O)Nc4ccccc4
InChi [?]:
InChI=1/C24H19N3O3S/c28-22(27-24-26-20(16-31-24)17-9-3-1-4-10-17)15-30-21-14-8-7-13-19(21)23(29)25-18-11-5-2-6-12-18/h1-14,16H,15H2,(H,25,29)(H,26,27,28)
InChi Info:
AuxInfo=1/1/N:1,29,2,6,28,30,20,19,3,5,27,31,21,18,15,8,4,26,22,7,17,13,23,10,25,11,12,14,24,16,9/E:(3,4)(5,6)(9,10)(11,12)/rA:31nCCCCCCCCSCNNCOCOCCCCCCCONCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;s9;s7d10;s10;s12;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;s22;d23;s23;s25;s26;d27;s28;d29;d26s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H19N3O3S |
All Atoms: | 50 |
Heavy Atoms: | 31 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 9.83702 |
Area: | 668.399 |
Solvation: | -6.87296 |
Coulombic: | -55.5588 |
Bond Count [?]
All: | 34 |
Single: | 21 |
Double: | 13 |
Rotors: | 9 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.48 |
LogP (Chemaxon): | None |
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 |
---|