BAS 01095002
TL;DR: BAS 01095002 (CAS 336175-87-2) is a chemical compound with molecular formula C33H30N2O3 and molecular weight 502.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[1-(4-methoxybenzoyl)-2-methyl-3,4-dihydro-2H-quinolin-4-yl]-N,3-diphenylprop-2-enamide
Also Known As: BAS 01095002, (2E)-N-{1-[(4-methoxyphenyl)carbonyl]-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl}-N,3-diphenylprop-2-enamide, N-(1-(4-methoxybenzoyl)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylcinnamamide, (E)-N-[1-(4-methoxybenzoyl)-2-methyl-3,4-dihydro-2H-quinolin-4-yl]-N,3-diphenylprop-2-enamide
| Molecular Formula | C33H30N2O3 |
|---|---|
| Molecular Weight | 502.23 g/mol |
| LogP | 6.9219 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 502.22565 |
| Heavy Atoms | 38 |
| Complexity | 1432.3289 |
Chemical Identifiers
| CAS Number | 336175-87-2 |
|---|---|
| SMILES | CC1CC(C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)OC)N(C4=CC=CC=C4)C(=O)/C=C/C5=CC=CC=C5 |
Product Overview
BAS 01095002 (CAS 336175-87-2), with molecular formula C33H30N2O3 and molecular weight 502.23 g/mol. IUPAC: (E)-N-[1-(4-methoxybenzoyl)-2-methyl-3,4-dihydro-2H-quinolin-4-yl]-N,3-diphenylprop-2-enamide.
Chemical Property Profile of BAS 01095002
Property Insights of BAS 01095002
The XLogP value of 6.9219 indicates that BAS 01095002 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, BAS 01095002 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01095002 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01095002?
The CAS number of BAS 01095002 is 336175-87-2.
What is the molecular formula of BAS 01095002?
The molecular formula of BAS 01095002 is C33H30N2O3.
What is the molecular weight of BAS 01095002?
The molecular weight of BAS 01095002 is 502.23 g/mol.
Where can I buy BAS 01095002?
You can request a quote for BAS 01095002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01095002?
Yes, KEHONG BIO provides custom synthesis services for BAS 01095002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.