UPCMLD0ENAT0505-4149:001
TL;DR: UPCMLD0ENAT0505-4149:001 (CAS 374919-34-3) is a chemical compound with molecular formula C26H21ClN2O2S2 and molecular weight 492.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-chloro-2-[(8-methoxy-4,4-dimethyl-5H-dithiolo[3,4-c]quinolin-1-ylidene)amino]phenyl]-phenylmethanone
Also Known As: UPCMLD0ENAT0505-4149:001, AF-399/40741302, [4-chloro-2-[(8-methoxy-4,4-dimethyl-5H-dithiolo[3,4-c]quinolin-1-ylidene)amino]phenyl]-phenylmethanone, (4-chloro-2-{[(1Z)-8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]amino}phenyl)(phenyl)methanone, N-(2-benzoyl-5-chlorophenyl)-8-methoxy-4,4-dimethyl-1H,4H,5H-[1,2]dithiolo[3,4-c]quinolin-1-imine
| Molecular Formula | C26H21ClN2O2S2 |
|---|---|
| Molecular Weight | 492.07 g/mol |
| LogP | 7.2626 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 492.0733 |
| Heavy Atoms | 33 |
| Complexity | 1438.4299 |
Chemical Identifiers
| CAS Number | 374919-34-3 |
|---|---|
| SMILES | CC1(C2=C(C3=C(N1)C=CC(=C3)OC)C(=NC4=C(C=CC(=C4)Cl)C(=O)C5=CC=CC=C5)SS2)C |
Product Overview
UPCMLD0ENAT0505-4149:001 (CAS 374919-34-3), with molecular formula C26H21ClN2O2S2 and molecular weight 492.07 g/mol. IUPAC: [4-chloro-2-[(8-methoxy-4,4-dimethyl-5H-dithiolo[3,4-c]quinolin-1-ylidene)amino]phenyl]-phenylmethanone.
Chemical Property Profile of UPCMLD0ENAT0505-4149:001
Property Insights of UPCMLD0ENAT0505-4149:001
The XLogP value of 7.2626 indicates that UPCMLD0ENAT0505-4149:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.69 Ų, UPCMLD0ENAT0505-4149:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0505-4149:001 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0505-4149:001?
The CAS number of UPCMLD0ENAT0505-4149:001 is 374919-34-3.
What is the molecular formula of UPCMLD0ENAT0505-4149:001?
The molecular formula of UPCMLD0ENAT0505-4149:001 is C26H21ClN2O2S2.
What is the molecular weight of UPCMLD0ENAT0505-4149:001?
The molecular weight of UPCMLD0ENAT0505-4149:001 is 492.07 g/mol.
Where can I buy UPCMLD0ENAT0505-4149:001?
You can request a quote for UPCMLD0ENAT0505-4149:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0505-4149:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0505-4149:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.