1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-
TL;DR: 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- (CAS 332027-14-2) is a chemical compound with molecular formula C13H19N3O and molecular weight 233.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-anilino-2-propan-2-ylpyrazolidine-1-carbaldehyde
Also Known As: 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-, 5-anilino-2-propan-2-ylpyrazolidine-1-carbaldehyde, BAS 00831260, 1-isopropyl-2-formyl-3-anilinopyrazolidine, 4-benzimidazol-2-yl-1,2,5-oxadiazole-3-ylamine
| Molecular Formula | C13H19N3O |
|---|---|
| Molecular Weight | 233.15 g/mol |
| LogP | 1.9121 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.15282 |
| Heavy Atoms | 17 |
| Complexity | 366.18713 |
Chemical Identifiers
| CAS Number | 332027-14-2 |
|---|---|
| SMILES | CC(C)N1CCC(N1C=O)NC2=CC=CC=C2 |
Product Overview
1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- (CAS 332027-14-2), with molecular formula C13H19N3O and molecular weight 233.15 g/mol. IUPAC: 5-anilino-2-propan-2-ylpyrazolidine-1-carbaldehyde.
Chemical Property Profile of 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-
Property Insights of 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-
The XLogP value of 1.9121 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-. With a topological polar surface area (TPSA) of 35.58 Ų, 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- has 1 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 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-?
The CAS number of 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- is 332027-14-2.
What is the molecular formula of 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-?
The molecular formula of 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- is C13H19N3O.
What is the molecular weight of 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-?
The molecular weight of 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- is 233.15 g/mol.
Where can I buy 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-?
You can request a quote for 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrazolidinecarboxaldehyde, 2-(1-methylethyl)-5-(phenylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.