UPCMLD0ENAT5371466:001
TL;DR: UPCMLD0ENAT5371466:001 (CAS 683795-97-3) is a chemical compound with molecular formula C28H28FN5O and molecular weight 469.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile
Also Known As: UPCMLD0ENAT5371466:001, 11-(4-(5-fluoro-2-methoxybenzyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile, 11-[4-(5-FLUORO-2-METHOXYBENZYL)-1-PIPERAZINYL]-7,8,9,10-TETRAHYDROBENZIMIDAZO[1,2-B]ISOQUINOLINE-6-CARBONITRILE, 11-[4-(5-fluoro-2-methoxybenzyl)piperazin-1-yl]-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile, 11-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile
| Molecular Formula | C28H28FN5O |
|---|---|
| Molecular Weight | 469.23 g/mol |
| LogP | 4.70788 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 469.22778 |
| Heavy Atoms | 35 |
| Complexity | 1462.2476 |
Chemical Identifiers
| CAS Number | 683795-97-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)F)CN2CCN(CC2)C3=C4CCCCC4=C(C5=NC6=CC=CC=C6N35)C#N |
Product Overview
UPCMLD0ENAT5371466:001 (CAS 683795-97-3), with molecular formula C28H28FN5O and molecular weight 469.23 g/mol. IUPAC: 11-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5371466:001
Property Insights of UPCMLD0ENAT5371466:001
The XLogP value of 4.70788 indicates that UPCMLD0ENAT5371466:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, UPCMLD0ENAT5371466:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5371466:001 has 0 hydrogen bond donor(s) and 5 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 UPCMLD0ENAT5371466:001?
The CAS number of UPCMLD0ENAT5371466:001 is 683795-97-3.
What is the molecular formula of UPCMLD0ENAT5371466:001?
The molecular formula of UPCMLD0ENAT5371466:001 is C28H28FN5O.
What is the molecular weight of UPCMLD0ENAT5371466:001?
The molecular weight of UPCMLD0ENAT5371466:001 is 469.23 g/mol.
Where can I buy UPCMLD0ENAT5371466:001?
You can request a quote for UPCMLD0ENAT5371466:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5371466:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5371466:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.