(6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide
TL;DR: (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide (CAS 137927-76-5) is a chemical compound with molecular formula C16H18N4O2S and molecular weight 330.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(4-methylphenoxy)pyrimidin-4-yl]sulfanyl-N-(propan-2-ylideneamino)acetamide
Also Known As: (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide, Acetic acid, ((6-(4-methylphenoxy)-4-pyrimidinyl)thio)-, (1-methylethylidene)hydrazide, ((6-(4-Methylphenoxy)-4-pyrimidinyl)thio)acetic acid (1-methylethylidene)hydrazide, 2-{[6-(4-methylphenoxy)pyrimidin-4-yl]sulfanyl}-N'-(propan-2-ylidene)acetohydrazide, 2-[6-(4-methylphenoxy)pyrimidin-4-yl]sulfanyl-N-(propan-2-ylideneamino)acetamide
| Molecular Formula | C16H18N4O2S |
|---|---|
| Molecular Weight | 330.12 g/mol |
| LogP | 3.18142 |
| Topological Polar Surface Area | 76.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 330.11505 |
| Heavy Atoms | 23 |
| Complexity | 697.4813 |
Chemical Identifiers
| CAS Number | 137927-76-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC2=CC(=NC=N2)SCC(=O)NN=C(C)C |
Product Overview
(6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide (CAS 137927-76-5), with molecular formula C16H18N4O2S and molecular weight 330.12 g/mol. IUPAC: 2-[6-(4-methylphenoxy)pyrimidin-4-yl]sulfanyl-N-(propan-2-ylideneamino)acetamide.
Chemical Property Profile of (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide
Property Insights of (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide
The XLogP value of 3.18142 indicates that (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide. Following Lipinski's Rule of Five, (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide?
The CAS number of (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide is 137927-76-5.
What is the molecular formula of (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide?
The molecular formula of (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide is C16H18N4O2S.
What is the molecular weight of (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide?
The molecular weight of (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide is 330.12 g/mol.
Where can I buy (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide?
You can request a quote for (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide?
Yes, KEHONG BIO provides custom synthesis services for (6-p-Tolyloxy-4-pyrimidinyl)thioacetic acid isopropylidenehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.