U 91736B
TL;DR: U 91736B (CAS 157012-69-6) is a chemical compound with molecular formula C21H25N5O and molecular weight 363.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-methyl-2,4-dipyrrolidin-1-ylpyrrolo[2,3-d]pyrimidin-6-yl)phenol
Also Known As: U 91736B, U-91736B, 7H-Pyrrolo[2,3-d]pyrimidine,phenol deriv., 2-(7-Methyl-2,4-di-1-pyrrolidinyl-7H-pyrrolo(2,3-d)pyrimidin-6-yl)phenol, 2-(7-methyl-2,4-dipyrrolidin-1-ylpyrrolo[2,3-d]pyrimidin-6-yl)phenol
| Molecular Formula | C21H25N5O |
|---|---|
| Molecular Weight | 363.21 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 57.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.2059 |
| Heavy Atoms | 27 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 157012-69-6 |
|---|---|
| SMILES | CN1C(=CC2=C1N=C(N=C2N3CCCC3)N4CCCC4)C5=CC=CC=C5O |
| InChIKey | WLTJDXFDYLFDCH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
U 91736B (CAS 157012-69-6), with molecular formula C21H25N5O and molecular weight 363.21 g/mol. IUPAC: 2-(7-methyl-2,4-dipyrrolidin-1-ylpyrrolo[2,3-d]pyrimidin-6-yl)phenol.
Chemical Property Profile of U 91736B
Property Insights of U 91736B
The XLogP value of 3.8 indicates that U 91736B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.4 Ų, U 91736B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, U 91736B 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 U 91736B?
The CAS number of U 91736B is 157012-69-6.
What is the molecular formula of U 91736B?
The molecular formula of U 91736B is C21H25N5O.
What is the molecular weight of U 91736B?
The molecular weight of U 91736B is 363.21 g/mol.
Where can I buy U 91736B?
You can request a quote for U 91736B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for U 91736B?
Yes, KEHONG BIO provides custom synthesis services for U 91736B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.