1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-
TL;DR: 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- (CAS 105577-50-2) is a chemical compound with molecular formula C21H18N2 and molecular weight 298.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,2-diphenyl-6,7-dihydro-5H-pyrrolizin-3-yl)acetonitrile
Also Known As: 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-, 2-(1,2-diphenyl-6,7-dihydro-5H-pyrrolizin-3-yl)acetonitrile, 1H-Pyrrolizine-5-acetonitrile,2,3-dihydro-6,7-diphenyl, (6,7-Diphenyl-2,3-dihydro-1H-pyrrolizin-5-yl)acetonitrile
| Molecular Formula | C21H18N2 |
|---|---|
| Molecular Weight | 298.15 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.147 |
| Heavy Atoms | 23 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 105577-50-2 |
|---|---|
| SMILES | C1CC2=C(C(=C(N2C1)CC#N)C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | NDRPMVLSDKJCQQ-UHFFFAOYSA-N |
Product Overview
1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- (CAS 105577-50-2), with molecular formula C21H18N2 and molecular weight 298.15 g/mol. IUPAC: 2-(1,2-diphenyl-6,7-dihydro-5H-pyrrolizin-3-yl)acetonitrile.
Chemical Property Profile of 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-
Property Insights of 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-
The XLogP value of 4.0 indicates that 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- has 0 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 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-?
The CAS number of 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- is 105577-50-2.
What is the molecular formula of 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-?
The molecular formula of 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- is C21H18N2.
What is the molecular weight of 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-?
The molecular weight of 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- is 298.15 g/mol.
Where can I buy 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-?
You can request a quote for 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrolizine-5-acetonitrile, 2,3-dihydro-6,7-diphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.