BAS 00381254
TL;DR: BAS 00381254 (CAS 296266-89-2) is a chemical compound with molecular formula C28H33BrN2O5 and molecular weight 556.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-(3-bromo-4-methoxyphenyl)-1-[4-(dimethylamino)phenyl]-2,6-dimethyl-4H-pyridine-3,5-dicarboxylate
Also Known As: BAS 00381254, 3,5-Diethyl 4-(3-bromo-4-methoxyphenyl)-1-[4-(dimethylamino)phenyl]-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, diethyl 4-(3-bromo-4-methoxyphenyl)-1-[4-(dimethylamino)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-Pyridinedicarboxylic acid, 4-(3-bromo-4-methoxyphenyl)-1-[4-(dimethylamino)phenyl]-1,4-dihydro-2,6-dimethyl-, 3,5-diethyl ester, 3,5-DIETHYL 4-(3-BROMO-4-METHOXYPHENYL)-1-[4-(DIMETHYLAMINO)PHENYL]-2,6-DIMETHYL-4H-PYRIDINE-3,5-DICARBOXYLATE
| Molecular Formula | C28H33BrN2O5 |
|---|---|
| Molecular Weight | 556.16 g/mol |
| LogP | 5.8017 |
| Topological Polar Surface Area | 68.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 556.1573 |
| Heavy Atoms | 36 |
| Complexity | 1158.9208 |
Chemical Identifiers
| CAS Number | 296266-89-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=C(C1C2=CC(=C(C=C2)OC)Br)C(=O)OCC)C)C3=CC=C(C=C3)N(C)C)C |
Product Overview
BAS 00381254 (CAS 296266-89-2), with molecular formula C28H33BrN2O5 and molecular weight 556.16 g/mol. IUPAC: diethyl 4-(3-bromo-4-methoxyphenyl)-1-[4-(dimethylamino)phenyl]-2,6-dimethyl-4H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of BAS 00381254
Property Insights of BAS 00381254
The XLogP value of 5.8017 indicates that BAS 00381254 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.31 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00381254. Following Lipinski's Rule of Five, BAS 00381254 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00381254?
The CAS number of BAS 00381254 is 296266-89-2.
What is the molecular formula of BAS 00381254?
The molecular formula of BAS 00381254 is C28H33BrN2O5.
What is the molecular weight of BAS 00381254?
The molecular weight of BAS 00381254 is 556.16 g/mol.
Where can I buy BAS 00381254?
You can request a quote for BAS 00381254 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00381254?
Yes, KEHONG BIO provides custom synthesis services for BAS 00381254 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.