![4-chloro-5H-pyrrolo[3,2-d]pyrimidine structure](/static/products/849/849052-15-9.png)
4-chloro-5H-pyrrolo[3,2-d]pyrimidine
TL;DR: 4-chloro-5H-pyrrolo[3,2-d]pyrimidine (CAS 849052-15-9) is a chemical compound with molecular formula C6H4ClN3 and molecular weight 153.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-5H-pyrrolo[3,2-d]pyrimidine
Also Known As: 4-chloro-5H-pyrrolo[3,2-d]pyrimidine, null, 4-CHLORO-5H-PYRROLO[3,2-D] PYRIMIDINE, Tofacitinib Impurity 262, 4-chloropyrrolo[3,2-d]pyrimidine
| Molecular Formula | C6H4ClN3 |
|---|---|
| Molecular Weight | 153.01 g/mol |
| LogP | 1.6113 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 153.00937 |
| Heavy Atoms | 10 |
| Complexity | 354.52042 |
Chemical Identifiers
| CAS Number | 849052-15-9 |
|---|---|
| SMILES | C1=CNC2=C1N=CN=C2Cl |
Product Overview
4-chloro-5H-pyrrolo[3,2-d]pyrimidine (CAS 849052-15-9), with molecular formula C6H4ClN3 and molecular weight 153.01 g/mol. IUPAC: 4-chloro-5H-pyrrolo[3,2-d]pyrimidine.
Chemical Property Profile of 4-chloro-5H-pyrrolo[3,2-d]pyrimidine
Property Insights of 4-chloro-5H-pyrrolo[3,2-d]pyrimidine
The XLogP value of 1.6113 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-5H-pyrrolo[3,2-d]pyrimidine. With a topological polar surface area (TPSA) of 41.57 Ų, 4-chloro-5H-pyrrolo[3,2-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-5H-pyrrolo[3,2-d]pyrimidine has 1 hydrogen bond donor(s) and 2 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 4-chloro-5H-pyrrolo[3,2-d]pyrimidine?
The CAS number of 4-chloro-5H-pyrrolo[3,2-d]pyrimidine is 849052-15-9.
What is the molecular formula of 4-chloro-5H-pyrrolo[3,2-d]pyrimidine?
The molecular formula of 4-chloro-5H-pyrrolo[3,2-d]pyrimidine is C6H4ClN3.
What is the molecular weight of 4-chloro-5H-pyrrolo[3,2-d]pyrimidine?
The molecular weight of 4-chloro-5H-pyrrolo[3,2-d]pyrimidine is 153.01 g/mol.
Where can I buy 4-chloro-5H-pyrrolo[3,2-d]pyrimidine?
You can request a quote for 4-chloro-5H-pyrrolo[3,2-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-5H-pyrrolo[3,2-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-5H-pyrrolo[3,2-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.