BAS 01404299
TL;DR: BAS 01404299 (CAS 330952-11-9) is a chemical compound with molecular formula C18H19ClN2O6 and molecular weight 394.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-(4-chloro-3-nitrophenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylate
Also Known As: BAS 01404299, A2443/0103592, dimethyl 4-(4-chloro-3-nitrophenyl)-1,2,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-Dimethyl 4-(4-chloro-3-nitrophenyl)-1,4-dihydro-1,2,6-trimethyl-3,5-pyridinedicarboxylate, dimethyl 4-(4-chloro-3-nitrophenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylate
| Molecular Formula | C18H19ClN2O6 |
|---|---|
| Molecular Weight | 394.09 g/mol |
| LogP | 3.1712 |
| Topological Polar Surface Area | 98.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.09317 |
| Heavy Atoms | 27 |
| Complexity | 849.8381 |
Chemical Identifiers
| CAS Number | 330952-11-9 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1C)C)C(=O)OC)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC |
Product Overview
BAS 01404299 (CAS 330952-11-9), with molecular formula C18H19ClN2O6 and molecular weight 394.09 g/mol. IUPAC: dimethyl 4-(4-chloro-3-nitrophenyl)-1,2,6-trimethyl-4H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of BAS 01404299
Property Insights of BAS 01404299
The XLogP value of 3.1712 indicates that BAS 01404299 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01404299. Following Lipinski's Rule of Five, BAS 01404299 has 0 hydrogen bond donor(s) and 7 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 BAS 01404299?
The CAS number of BAS 01404299 is 330952-11-9.
What is the molecular formula of BAS 01404299?
The molecular formula of BAS 01404299 is C18H19ClN2O6.
What is the molecular weight of BAS 01404299?
The molecular weight of BAS 01404299 is 394.09 g/mol.
Where can I buy BAS 01404299?
You can request a quote for BAS 01404299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404299?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.