Isopryn, phenylbutazone drug combination
TL;DR: Isopryn, phenylbutazone drug combination (CAS 8058-14-8) is a chemical compound with molecular formula C62H75N5O18 and molecular weight 1177.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butyl-1,2-diphenylpyrazolidine-3,5-dione;1,5-dimethyl-2-phenyl-4-(propan-2-ylamino)pyrazol-3-one;(E)-3-(3-hydroxy-4-methoxyphenyl)-1-[2-hydroxy-6-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]prop-2-en-1-one
Also Known As: Tomanil, Tomanol, Isopryn-phenybutazone, Isopryn - phenybutazone, Isopryn, phenylbutazone drug combination
| Molecular Formula | C62H75N5O18 |
|---|---|
| Molecular Weight | 1177.51 g/mol |
| LogP | 5.13412 |
| Topological Polar Surface Area | 313.87 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 18 |
| Exact Mass | 1177.5107 |
| Heavy Atoms | 85 |
| Complexity | 3229.2947 |
Chemical Identifiers
| CAS Number | 8058-14-8 |
|---|---|
| SMILES | CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3.C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC(=C(C(=C3)OC)C(=O)/C=C/C4=CC(=C(C=C4)OC)O)O)O)O)O)O)O)O.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(C)C |
Product Overview
Isopryn, phenylbutazone drug combination (CAS 8058-14-8), with molecular formula C62H75N5O18 and molecular weight 1177.51 g/mol. IUPAC: 4-butyl-1,2-diphenylpyrazolidine-3,5-dione;1,5-dimethyl-2-phenyl-4-(propan-2-ylamino)pyrazol-3-one;(E)-3-(3-hydroxy-4-methoxyphenyl)-1-[2-hydroxy-6-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]prop-2-en-1-one.
Chemical Property Profile of Isopryn, phenylbutazone drug combination
Property Insights of Isopryn, phenylbutazone drug combination
The XLogP value of 5.13412 indicates that Isopryn, phenylbutazone drug combination is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 313.87 Ų indicates high polarity, suggesting Isopryn, phenylbutazone drug combination may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isopryn, phenylbutazone drug combination has 9 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isopryn, phenylbutazone drug combination?
The CAS number of Isopryn, phenylbutazone drug combination is 8058-14-8.
What is the molecular formula of Isopryn, phenylbutazone drug combination?
The molecular formula of Isopryn, phenylbutazone drug combination is C62H75N5O18.
What is the molecular weight of Isopryn, phenylbutazone drug combination?
The molecular weight of Isopryn, phenylbutazone drug combination is 1177.51 g/mol.
Where can I buy Isopryn, phenylbutazone drug combination?
You can request a quote for Isopryn, phenylbutazone drug combination directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopryn, phenylbutazone drug combination?
Yes, KEHONG BIO provides custom synthesis services for Isopryn, phenylbutazone drug combination and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.