UPCMLD0ENAT5747519:001
TL;DR: UPCMLD0ENAT5747519:001 (CAS 305333-87-3) is a chemical compound with molecular formula C27H27N5O and molecular weight 437.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-[4-[(4-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: UPCMLD0ENAT5747519:001, BIM-0035955.P001, 11-(4-(4-methoxybenzyl)piperazin-1-yl)-2,3-dihydro-1H-benzo[4,5]imidazo[1,2-a]cyclopenta[d]pyridine-4-carbonitrile, 11-[4-(4-methoxybenzyl)piperazin-1-yl]-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile, 11-[4-(4-METHOXYBENZYL)PIPERAZINO]-2,3-DIHYDRO-1H-CYCLOPENTA[4,5]PYRIDO[1,2-A][1,3]BENZIMIDAZOL-4-YL CYANIDE
| Molecular Formula | C27H27N5O |
|---|---|
| Molecular Weight | 437.22 g/mol |
| LogP | 4.17868 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 437.22156 |
| Heavy Atoms | 33 |
| Complexity | 1374.1642 |
Chemical Identifiers
| CAS Number | 305333-87-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2CCN(CC2)C3=C4CCCC4=C(C5=NC6=CC=CC=C6N35)C#N |
Product Overview
UPCMLD0ENAT5747519:001 (CAS 305333-87-3), with molecular formula C27H27N5O and molecular weight 437.22 g/mol. IUPAC: 16-[4-[(4-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 UPCMLD0ENAT5747519:001
Property Insights of UPCMLD0ENAT5747519:001
The XLogP value of 4.17868 indicates that UPCMLD0ENAT5747519:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, UPCMLD0ENAT5747519:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5747519:001 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 UPCMLD0ENAT5747519:001?
The CAS number of UPCMLD0ENAT5747519:001 is 305333-87-3.
What is the molecular formula of UPCMLD0ENAT5747519:001?
The molecular formula of UPCMLD0ENAT5747519:001 is C27H27N5O.
What is the molecular weight of UPCMLD0ENAT5747519:001?
The molecular weight of UPCMLD0ENAT5747519:001 is 437.22 g/mol.
Where can I buy UPCMLD0ENAT5747519:001?
You can request a quote for UPCMLD0ENAT5747519:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5747519:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5747519:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.