![4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b structure](/static/products/189/189747-46-4.png)
4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b
TL;DR: 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b (CAS 189747-46-4) is a chemical compound with molecular formula C12H9BrN6 and molecular weight 316.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(3-bromophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine
Also Known As: 4-anilinopyrimido[5,4-d]pyrimidine deriv. 5b, 6-Amino-4-(3-bromoanilino)pyrimido[5,4-d]pyrimidine, Pyrimido[5,4-d]pyrimidine-2,8-diamine, N8-(3-bromophenyl)-, 4-N-(3-bromophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine, 6-Amino-4-[(3-bromophenyl)amino]pyrimido[5,4-d]pyrimidine
| Molecular Formula | C12H9BrN6 |
|---|---|
| Molecular Weight | 316.01 g/mol |
| LogP | 2.5081 |
| Topological Polar Surface Area | 89.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.0072 |
| Heavy Atoms | 19 |
| Complexity | 745.12115 |
Chemical Identifiers
| CAS Number | 189747-46-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)NC2=NC=NC3=CN=C(N=C32)N |
Product Overview
4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b (CAS 189747-46-4), with molecular formula C12H9BrN6 and molecular weight 316.01 g/mol. IUPAC: 4-N-(3-bromophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine.
Chemical Property Profile of 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b
Property Insights of 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b
The XLogP value of 2.5081 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b. The TPSA of 89.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b. Following Lipinski's Rule of Five, 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b 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 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b?
The CAS number of 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b is 189747-46-4.
What is the molecular formula of 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b?
The molecular formula of 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b is C12H9BrN6.
What is the molecular weight of 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b?
The molecular weight of 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b is 316.01 g/mol.
Where can I buy 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b?
You can request a quote for 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b?
Yes, KEHONG BIO provides custom synthesis services for 4-Anilinopyrimido[5,4-d]pyrimidine deriv. 5b and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.