UPCMLD0ENAT5747470:001
TL;DR: UPCMLD0ENAT5747470:001 (CAS 385385-24-0) is a chemical compound with molecular formula C34H33N5O and molecular weight 527.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-[4-(2-benzhydryloxyethyl)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: UPCMLD0ENAT5747470:001, 11-{4-[2-(diphenylmethoxy)ethyl]piperazin-1-yl}-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile, 11-(4-(2-(benzhydryloxy)ethyl)piperazin-1-yl)-2,3-dihydro-1H-benzo[4,5]imidazo[1,2-a]cyclopenta[d]pyridine-4-carbonitrile, 11-{4-[2-(benzhydryloxy)ethyl]-1-piperazinyl}-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile, 11-{4-[2-(diphenylmethoxy)ethyl]piperazinyl}-1,2,3,10-tetrahydrobenzimidazolo[ 1,2-a]cyclopenta[1,2-d]pyridine-4-carbonitrile
| Molecular Formula | C34H33N5O |
|---|---|
| Molecular Weight | 527.27 g/mol |
| LogP | 5.77608 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 527.2685 |
| Heavy Atoms | 40 |
| Complexity | 1641.166 |
Chemical Identifiers
| CAS Number | 385385-24-0 |
|---|---|
| SMILES | C1CC2=C(C3=NC4=CC=CC=C4N3C(=C2C1)N5CCN(CC5)CCOC(C6=CC=CC=C6)C7=CC=CC=C7)C#N |
Product Overview
UPCMLD0ENAT5747470:001 (CAS 385385-24-0), with molecular formula C34H33N5O and molecular weight 527.27 g/mol. IUPAC: 16-[4-(2-benzhydryloxyethyl)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 UPCMLD0ENAT5747470:001
Property Insights of UPCMLD0ENAT5747470:001
The XLogP value of 5.77608 indicates that UPCMLD0ENAT5747470:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, UPCMLD0ENAT5747470:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5747470:001 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5747470:001?
The CAS number of UPCMLD0ENAT5747470:001 is 385385-24-0.
What is the molecular formula of UPCMLD0ENAT5747470:001?
The molecular formula of UPCMLD0ENAT5747470:001 is C34H33N5O.
What is the molecular weight of UPCMLD0ENAT5747470:001?
The molecular weight of UPCMLD0ENAT5747470:001 is 527.27 g/mol.
Where can I buy UPCMLD0ENAT5747470:001?
You can request a quote for UPCMLD0ENAT5747470:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5747470:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5747470:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.