N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine
TL;DR: N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine (CAS 31079-46-6) is a chemical compound with molecular formula C10H10Cl2N2 and molecular weight 228.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine
Also Known As: N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine, (3,4-dichlorophenyl)-1-pyrrolin-2-ylamine
| Molecular Formula | C10H10Cl2N2 |
|---|---|
| Molecular Weight | 228.02 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.02211 |
| Heavy Atoms | 14 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 31079-46-6 |
|---|---|
| SMILES | C1CC(=NC1)NC2=CC(=C(C=C2)Cl)Cl |
| InChIKey | QJYDWXXPXYARJI-UHFFFAOYSA-N |
Product Overview
N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine (CAS 31079-46-6), with molecular formula C10H10Cl2N2 and molecular weight 228.02 g/mol. IUPAC: N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine.
Chemical Property Profile of N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine
Property Insights of N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine. With a topological polar surface area (TPSA) of 24.4 Ų, N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine has 1 hydrogen bond donor(s) and 1 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 N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine?
The CAS number of N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine is 31079-46-6.
What is the molecular formula of N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine?
The molecular formula of N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine is C10H10Cl2N2.
What is the molecular weight of N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine?
The molecular weight of N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine is 228.02 g/mol.
Where can I buy N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine?
You can request a quote for N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.