氨苯蝶啶
TL;DR: 氨苯蝶啶 (CAS 396-01-0) is a chemical compound with molecular formula C12H11N7 and molecular weight 253.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氨苯蝶啶
6-phenylpteridine-2,4,7-triamine
Also Known As: triamterene, Dyrenium, Dytac, Pterophene, Triamteren
| Molecular Formula | C12H11N7 |
|---|---|
| Molecular Weight | 253.11 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.10759 |
| Heavy Atoms | 19 |
| Complexity | 306.0 |
| Melting Point | 316.1 °C |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 396-01-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=C(N=C(N=C3N=C2N)N)N |
| InChIKey | FNYLWPVRPXGIIP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氨苯蝶啶 (CAS 396-01-0), with molecular formula C12H11N7 and molecular weight 253.11 g/mol. IUPAC: 6-phenylpteridine-2,4,7-triamine.
Chemical Property Profile of 氨苯蝶啶
Property Insights of 氨苯蝶啶
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氨苯蝶啶. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 氨苯蝶啶. Following Lipinski's Rule of Five, 氨苯蝶啶 has 3 hydrogen bond donor(s) and 7 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 氨苯蝶啶?
The CAS number of 氨苯蝶啶 is 396-01-0.
What is the molecular formula of 氨苯蝶啶?
The molecular formula of 氨苯蝶啶 is C12H11N7.
What is the molecular weight of 氨苯蝶啶?
The molecular weight of 氨苯蝶啶 is 253.11 g/mol.
Where can I buy 氨苯蝶啶?
You can request a quote for 氨苯蝶啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氨苯蝶啶?
Yes, KEHONG BIO provides custom synthesis services for 氨苯蝶啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.