3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
TL;DR: 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione (CAS 98792-17-7) is a chemical compound with molecular formula C11H10N4O3 and molecular weight 246.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-8-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione
Also Known As: 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione, 3-amino-8-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione, 1H-Pyrimido[5,4-b]indole-2,4(3H,5H)-dione, 3-amino-8-methoxy-, 1H-Pyrimido[5,4-b]indole-2,4(3H,5H)-dione,3-amino-8-methoxy
| Molecular Formula | C11H10N4O3 |
|---|---|
| Molecular Weight | 246.08 g/mol |
| LogP | -0.1065 |
| Topological Polar Surface Area | 105.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 246.07529 |
| Heavy Atoms | 18 |
| Complexity | 871.4877 |
Chemical Identifiers
| CAS Number | 98792-17-7 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)NC3=C2NC(=O)N(C3=O)N |
Product Overview
3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione (CAS 98792-17-7), with molecular formula C11H10N4O3 and molecular weight 246.08 g/mol. IUPAC: 3-amino-8-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione.
Chemical Property Profile of 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Property Insights of 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
The XLogP value of -0.1065 indicates that 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 105.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione has 3 hydrogen bond donor(s) and 4 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 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
The CAS number of 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione is 98792-17-7.
What is the molecular formula of 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
The molecular formula of 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione is C11H10N4O3.
What is the molecular weight of 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
The molecular weight of 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione is 246.08 g/mol.
Where can I buy 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
You can request a quote for 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.