BW 49-371
TL;DR: BW 49-371 (CAS 76299-62-2) is a chemical compound with molecular formula C12H13N5O2 and molecular weight 259.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-5-[(4-nitrophenyl)methyl]pyrimidine-2,4-diamine
Also Known As: 6-Methyl-5- pyrimidine-2,4-diamine, 2,4-Diamino-5-(p-nitrobenzyl)-6-methylpyrimidine, 6-methyl-5-[(4-nitrophenyl)methyl]pyrimidine-2,4-diamine, 2,4-Diamino-5-(4'-nitrobenzyl)-6-methylpyrimidine, 4-25-00-03013 (Beilstein Handbook Reference)
| Molecular Formula | C12H13N5O2 |
|---|---|
| Molecular Weight | 259.11 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.10693 |
| Heavy Atoms | 19 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 76299-62-2 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)N)N)CC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | SLGQNHYYIRHGIG-UHFFFAOYSA-N |
Product Overview
BW 49-371 (CAS 76299-62-2), with molecular formula C12H13N5O2 and molecular weight 259.11 g/mol. IUPAC: 6-methyl-5-[(4-nitrophenyl)methyl]pyrimidine-2,4-diamine.
Chemical Property Profile of BW 49-371
Property Insights of BW 49-371
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BW 49-371. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BW 49-371. Following Lipinski's Rule of Five, BW 49-371 has 2 hydrogen bond donor(s) and 6 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 BW 49-371?
The CAS number of BW 49-371 is 76299-62-2.
What is the molecular formula of BW 49-371?
The molecular formula of BW 49-371 is C12H13N5O2.
What is the molecular weight of BW 49-371?
The molecular weight of BW 49-371 is 259.11 g/mol.
Where can I buy BW 49-371?
You can request a quote for BW 49-371 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BW 49-371?
Yes, KEHONG BIO provides custom synthesis services for BW 49-371 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.