D04QIA
TL;DR: D04QIA (CAS 304025-53-4) is a chemical compound with molecular formula C36H47N3O5 and molecular weight 601.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[7-[[(3R,4R)-4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]piperidin-3-yl]oxymethyl]-3,4-dihydro-2H-quinolin-1-yl]ethyl]acetamide
Also Known As: Ro-66-1168, J1.518.175C, Acetamide,N-[2-[3,4-dihydro-7-[[[(3R,4R)-4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]-3-piperidinyl]oxy]methyl]-1(2H)-quinolinyl]ethyl]-, (3R,4R)-N-[2-[7-[4-[4-[3-(2-methoxy-benzyloxy)-propoxy]-phenyl]-piperidin-3-yloxymethyl]-3,4-dihydro-2H-quinolin-1-yl]-ethyl]-acetamide, Acetamide, N-[2-[3,4-dihydro-7-[[[(3R,4R)-4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]-3-piperidinyl]oxy]methyl]-1(2H)-quinolinyl]ethyl]-
| Molecular Formula | C36H47N3O5 |
|---|---|
| Molecular Weight | 601.35 g/mol |
| LogP | 5.2319 |
| Topological Polar Surface Area | 81.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 601.35156 |
| Heavy Atoms | 44 |
| Complexity | 1331.6017 |
Chemical Identifiers
| CAS Number | 304025-53-4 |
|---|---|
| SMILES | CC(=O)NCCN1CCCC2=C1C=C(C=C2)CO[C@H]3CNCC[C@@H]3C4=CC=C(C=C4)OCCCOCC5=CC=CC=C5OC |
Product Overview
D04QIA (CAS 304025-53-4), with molecular formula C36H47N3O5 and molecular weight 601.35 g/mol. IUPAC: N-[2-[7-[[(3R,4R)-4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]piperidin-3-yl]oxymethyl]-3,4-dihydro-2H-quinolin-1-yl]ethyl]acetamide.
Chemical Property Profile of D04QIA
Property Insights of D04QIA
The XLogP value of 5.2319 indicates that D04QIA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.29 Ų falls within the moderate polarity range, balancing permeability and solubility for D04QIA. Following Lipinski's Rule of Five, D04QIA has 2 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 D04QIA?
The CAS number of D04QIA is 304025-53-4.
What is the molecular formula of D04QIA?
The molecular formula of D04QIA is C36H47N3O5.
What is the molecular weight of D04QIA?
The molecular weight of D04QIA is 601.35 g/mol.
Where can I buy D04QIA?
You can request a quote for D04QIA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D04QIA?
Yes, KEHONG BIO provides custom synthesis services for D04QIA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.