3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol
TL;DR: 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol (CAS 354770-67-5) is a chemical compound with molecular formula C16H13ClN2O2 and molecular weight 300.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-anilino-4-chloro-1-phenylpyrrole-2,5-diol
Also Known As: 3-anilino-4-chloro-1-phenylpyrrole-2,5-diol, 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol, 4-chloro-1-phenyl-3-(phenylamino)pyrrole-2,5-diol
| Molecular Formula | C16H13ClN2O2 |
|---|---|
| Molecular Weight | 300.07 g/mol |
| LogP | 4.2855 |
| Topological Polar Surface Area | 57.42 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.06656 |
| Heavy Atoms | 21 |
| Complexity | 754.95306 |
Chemical Identifiers
| CAS Number | 354770-67-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C(N(C(=C2Cl)O)C3=CC=CC=C3)O |
Product Overview
3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol (CAS 354770-67-5), with molecular formula C16H13ClN2O2 and molecular weight 300.07 g/mol. IUPAC: 3-anilino-4-chloro-1-phenylpyrrole-2,5-diol.
Chemical Property Profile of 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol
Property Insights of 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol
The XLogP value of 4.2855 indicates that 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.42 Ų, 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol has 3 hydrogen bond donor(s) and 3 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-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol?
The CAS number of 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol is 354770-67-5.
What is the molecular formula of 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol?
The molecular formula of 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol is C16H13ClN2O2.
What is the molecular weight of 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol?
The molecular weight of 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol is 300.07 g/mol.
Where can I buy 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol?
You can request a quote for 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-1-phenyl-4-(phenylamino)-1H-pyrrole-2,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.