![3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one structure](/static/products/858/858762-73-9.png)
3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one
TL;DR: 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 858762-73-9) is a chemical compound with molecular formula C18H23N3O4 and molecular weight 345.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,8-dimethoxy-3-(3-propan-2-yloxypropyl)-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one, 7,8-dimethoxy-3-(3-propan-2-yloxypropyl)-5H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C18H23N3O4 |
|---|---|
| Molecular Weight | 345.17 g/mol |
| LogP | 2.7101 |
| Topological Polar Surface Area | 78.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.16885 |
| Heavy Atoms | 25 |
| Complexity | 942.7801 |
Chemical Identifiers
| CAS Number | 858762-73-9 |
|---|---|
| SMILES | CC(C)OCCCN1C=NC2=C(C1=O)NC3=CC(=C(C=C32)OC)OC |
Product Overview
3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 858762-73-9), with molecular formula C18H23N3O4 and molecular weight 345.17 g/mol. IUPAC: 7,8-dimethoxy-3-(3-propan-2-yloxypropyl)-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one
Property Insights of 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one
The XLogP value of 2.7101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one. The TPSA of 78.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one. Following Lipinski's Rule of Five, 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one has 1 hydrogen bond donor(s) and 5 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-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
The CAS number of 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one is 858762-73-9.
What is the molecular formula of 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular formula of 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one is C18H23N3O4.
What is the molecular weight of 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular weight of 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one is 345.17 g/mol.
Where can I buy 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
You can request a quote for 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-isopropoxypropyl)-7,8-dimethoxy-3H-pyrimido[5,4-b]indol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.