UPCMLD0ENAT0502-5723:001
TL;DR: UPCMLD0ENAT0502-5723:001 (CAS 304683-79-2) is a chemical compound with molecular formula C21H16F2N4O2 and molecular weight 394.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-[4-(difluoromethoxy)phenyl]-3-methyl-1-phenyl-4H-pyrano[3,2-d]pyrazole-5-carbonitrile
Also Known As: UPCMLD0ENAT0502-5723:001, AE-848/12560112, F0307-0270, 6-amino-4-[4-(difluoromethoxy)phenyl]-3-methyl-1-phenyl-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(4-(difluoromethoxy)phenyl)-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C21H16F2N4O2 |
|---|---|
| Molecular Weight | 394.12 g/mol |
| LogP | 4.0003 |
| Topological Polar Surface Area | 86.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.12415 |
| Heavy Atoms | 29 |
| Complexity | 1116.078 |
Chemical Identifiers
| CAS Number | 304683-79-2 |
|---|---|
| SMILES | CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)OC(F)F)C4=CC=CC=C4 |
Product Overview
UPCMLD0ENAT0502-5723:001 (CAS 304683-79-2), with molecular formula C21H16F2N4O2 and molecular weight 394.12 g/mol. IUPAC: 6-amino-4-[4-(difluoromethoxy)phenyl]-3-methyl-1-phenyl-4H-pyrano[3,2-d]pyrazole-5-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT0502-5723:001
Property Insights of UPCMLD0ENAT0502-5723:001
The XLogP value of 4.0003 indicates that UPCMLD0ENAT0502-5723:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.09 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0502-5723:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0502-5723:001 has 1 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 UPCMLD0ENAT0502-5723:001?
The CAS number of UPCMLD0ENAT0502-5723:001 is 304683-79-2.
What is the molecular formula of UPCMLD0ENAT0502-5723:001?
The molecular formula of UPCMLD0ENAT0502-5723:001 is C21H16F2N4O2.
What is the molecular weight of UPCMLD0ENAT0502-5723:001?
The molecular weight of UPCMLD0ENAT0502-5723:001 is 394.12 g/mol.
Where can I buy UPCMLD0ENAT0502-5723:001?
You can request a quote for UPCMLD0ENAT0502-5723:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0502-5723:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0502-5723:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.