Nifuroksazid : Osobine, Reference, Literatura, Spoljašnje veze Википедија

Nifuroksazid

Nifuroksazid
Klinički podaci

Drugs.com	Monografija
Identifikatori
CAS broj	965-52-6^Y
ATC kod	A07AX03 (WHO)
PubChem	CID 5337997
ChemSpider	4495115^Y
UNII	PM5LI0P38J^Y
KEGG	D07111^Y
ChEMBL	CHEMBL244888^Y
Hemijski podaci
Formula	C₁₂H₉N₃O₅
Molarna masa	275,217
SMILES Oc1ccc(cc1)C(=O)N\N=C\c2oc(cc2)[N+](=O)[O-]
InChI InChI=1S/C12H9N3O5/c16-9-3-1-8(2-4-9)12(17)14-13-7-10-5-6-11(20-10)15(18)19/h1-7,16H,(H,14,17)/b13-7+^Y Key:YCWSUKQGVSGXJO-NTUHNPAUSA-N^Y

Nifuroksazid je organsko jedinjenje, koje sadrži 12 atoma ugljenika i ima molekulsku masu od 275,217 Da.

Osobine

Osobina	Vrednost
Broj akceptora vodonika	5
Broj donora vodonika	2
Broj rotacionih veza	4
Particioni koeficijent^[1] (ALogP)	1,9
Rastvorljivost^[2] (logS, log(mol/L))	-4,0
Polarna površina^[3] (PSA, Å²)	120,7

^ Ghose, A.K.; Viswanadhan V.N. & Wendoloski, J.J. (1998). „Prediction of Hydrophobic (Lipophilic) Properties of Small Organic Molecules Using Fragment Methods: An Analysis of AlogP and CLogP Methods”. J. Phys. Chem. A. 102: 3762—3772. doi:10.1021/jp980230o.
^ Tetko IV, Tanchuk VY, Kasheva TN, Villa AE (2001). „Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices”. Chem Inf. Comput. Sci. 41: 1488—1493. PMID 11749573. doi:10.1021/ci000392t.
^ Ertl P.; Rohde B.; Selzer P. (2000). „Fast calculation of molecular polar surface area as a sum of fragment based contributions and its application to the prediction of drug transport properties”. J. Med. Chem. 43: 3714—3717. PMID 11020286. doi:10.1021/jm000942e.

Hardman JG, Limbird LE, Gilman AG (2001). Goodman & Gilman's The Pharmacological Basis of Therapeutics (10. изд.). New York: McGraw-Hill. ISBN 0071354697. doi:10.1036/0071422803.
Thomas L. Lemke; David A. Williams, ур. (2007). Foye's Principles of Medicinal Chemistry (6. изд.). Baltimore: Lippincott Willams & Wilkins. ISBN 0781768799.