1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride
TL;DR: 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride (CAS 70886-87-2) is a chemical compound with molecular formula C23H24ClN3O and molecular weight 393.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diethyl-5-methyl-4,7-diphenylpyrrolo[3,4-d]pyrimidin-2-one;hydrochloride
Also Known As: 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride, 1,3-Diethyl-4,7-diphenyl-5-methyl-1H-pyrrolo(3,4-d)pyrimidin-2(3H)-one hydrochloride, 1,3-diethyl-5-methyl-4,7-diphenylpyrrolo[3,4-d]pyrimidin-2-one hydrochloride, 1,3-Diethyl-5-methyl-4,7-diphenyl-1,3-dihydro-2H-pyrrolo[3,4-d]pyrimidin-2-one--hydrogen chloride (1/1), RefChem:240885
| Molecular Formula | C23H24ClN3O |
|---|---|
| Molecular Weight | 393.16 g/mol |
| LogP | 5.25362 |
| Topological Polar Surface Area | 39.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.1608 |
| Heavy Atoms | 28 |
| Complexity | 1114.2764 |
Chemical Identifiers
| CAS Number | 70886-87-2 |
|---|---|
| SMILES | CCN1C(=C2C(=NC(=C2N(C1=O)CC)C3=CC=CC=C3)C)C4=CC=CC=C4.Cl |
Product Overview
1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride (CAS 70886-87-2), with molecular formula C23H24ClN3O and molecular weight 393.16 g/mol. IUPAC: 1,3-diethyl-5-methyl-4,7-diphenylpyrrolo[3,4-d]pyrimidin-2-one;hydrochloride.
Chemical Property Profile of 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride
Property Insights of 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride
The XLogP value of 5.25362 indicates that 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.82 Ų, 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride?
The CAS number of 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride is 70886-87-2.
What is the molecular formula of 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride?
The molecular formula of 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride is C23H24ClN3O.
What is the molecular weight of 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride?
The molecular weight of 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride is 393.16 g/mol.
Where can I buy 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride?
You can request a quote for 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrolo(3,4-d)pyrimidin-2(3H)-one, 1,3-diethyl-4,7-diphenyl-5-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.