A3301/0140271
TL;DR: A3301/0140271 (CAS 695192-85-9) is a chemical compound with molecular formula C20H16ClF2N3O3 and molecular weight 419.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-4-phenyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Also Known As: A3301/0140271, 6-{4-[chloro(difluoro)methoxy]phenyl}-1-methyl-4-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione, 6-(4-(chlorodifluoromethoxy)phenyl)-1-methyl-4-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione, 6-[4-(CHLORODIFLUOROMETHOXY)PHENYL]-1-METHYL-4-PHENYL-1H,2H,3H,4H,5H,6H,7H-PYRROLO[3,4-D]PYRIMIDINE-2,5-DIONE, 6-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-4-phenyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
| Molecular Formula | C20H16ClF2N3O3 |
|---|---|
| Molecular Weight | 419.08 g/mol |
| LogP | 3.8515 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.08484 |
| Heavy Atoms | 29 |
| Complexity | 990.28107 |
Chemical Identifiers
| CAS Number | 695192-85-9 |
|---|---|
| SMILES | CN1C2=C(C(NC1=O)C3=CC=CC=C3)C(=O)N(C2)C4=CC=C(C=C4)OC(F)(F)Cl |
Product Overview
A3301/0140271 (CAS 695192-85-9), with molecular formula C20H16ClF2N3O3 and molecular weight 419.08 g/mol. IUPAC: 6-[4-[chloro(difluoro)methoxy]phenyl]-1-methyl-4-phenyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione.
Chemical Property Profile of A3301/0140271
Property Insights of A3301/0140271
The XLogP value of 3.8515 indicates that A3301/0140271 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for A3301/0140271. Following Lipinski's Rule of Five, A3301/0140271 has 1 hydrogen bond donor(s) and 3 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 A3301/0140271?
The CAS number of A3301/0140271 is 695192-85-9.
What is the molecular formula of A3301/0140271?
The molecular formula of A3301/0140271 is C20H16ClF2N3O3.
What is the molecular weight of A3301/0140271?
The molecular weight of A3301/0140271 is 419.08 g/mol.
Where can I buy A3301/0140271?
You can request a quote for A3301/0140271 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3301/0140271?
Yes, KEHONG BIO provides custom synthesis services for A3301/0140271 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.