UPCMLD0ENAT5748137:001
TL;DR: UPCMLD0ENAT5748137:001 (CAS 384352-72-1) is a chemical compound with molecular formula C27H26ClN5O and molecular weight 471.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-[4-[(5-chloro-2-methoxyphenyl)methyl]piperazin-1-yl]-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile
Also Known As: UPCMLD0ENAT5748137:001, A3421/0145156, 16-{4-[(5-chloro-2-methoxyphenyl)methyl]piperazin-1-yl}-1,8-diazatetracyclo[7.7.0.0^{2,7}.0^{11,15}]hexadeca-2(7),3,5,8,10,15-hexaene-10-carbonitrile, F1126-0059, 11-(4-(5-chloro-2-methoxybenzyl)piperazin-1-yl)-2,3-dihydro-1H-benzo[4,5]imidazo[1,2-a]cyclopenta[d]pyridine-4-carbonitrile
| Molecular Formula | C27H26ClN5O |
|---|---|
| Molecular Weight | 471.18 g/mol |
| LogP | 4.83208 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 471.1826 |
| Heavy Atoms | 34 |
| Complexity | 1445.443 |
Chemical Identifiers
| CAS Number | 384352-72-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)CN2CCN(CC2)C3=C4CCCC4=C(C5=NC6=CC=CC=C6N35)C#N |
Product Overview
UPCMLD0ENAT5748137:001 (CAS 384352-72-1), with molecular formula C27H26ClN5O and molecular weight 471.18 g/mol. IUPAC: 16-[4-[(5-chloro-2-methoxyphenyl)methyl]piperazin-1-yl]-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5748137:001
Property Insights of UPCMLD0ENAT5748137:001
The XLogP value of 4.83208 indicates that UPCMLD0ENAT5748137:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, UPCMLD0ENAT5748137:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5748137:001 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 UPCMLD0ENAT5748137:001?
The CAS number of UPCMLD0ENAT5748137:001 is 384352-72-1.
What is the molecular formula of UPCMLD0ENAT5748137:001?
The molecular formula of UPCMLD0ENAT5748137:001 is C27H26ClN5O.
What is the molecular weight of UPCMLD0ENAT5748137:001?
The molecular weight of UPCMLD0ENAT5748137:001 is 471.18 g/mol.
Where can I buy UPCMLD0ENAT5748137:001?
You can request a quote for UPCMLD0ENAT5748137:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5748137:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5748137:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.