二乙氨基-2-丁炔基琥珀酰亚胺
TL;DR: 二乙氨基-2-丁炔基琥珀酰亚胺 (CAS 7591-19-7) is a chemical compound with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二乙氨基-2-丁炔基琥珀酰亚胺
3-[4-(diethylamino)but-2-ynyl]pyrrolidine-2,5-dione
Also Known As: Diethylamino-2-butynylsuccinimide, 3-[4-(diethylamino)but-2-ynyl]pyrrolidine-2,5-dione, 3-(4-diethylaminobut-2-ynyl)pyrrolidine-2,5-dione, 3-but-1-ynyl-3-(diethylamino)pyrrolidine-2,5-dione, 2,5-Pyrrolidinedione, 1-(4-(diethylamino)-2-butynyl)-
| Molecular Formula | C12H18N2O2 |
|---|---|
| Molecular Weight | 222.14 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.13683 |
| Heavy Atoms | 16 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 7591-19-7 |
|---|---|
| SMILES | CCN(CC)CC#CCC1CC(=O)NC1=O |
| InChIKey | YRECZPQEZNWZEK-UHFFFAOYSA-N |
Product Overview
二乙氨基-2-丁炔基琥珀酰亚胺 (CAS 7591-19-7), with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol. IUPAC: 3-[4-(diethylamino)but-2-ynyl]pyrrolidine-2,5-dione.
Chemical Property Profile of 二乙氨基-2-丁炔基琥珀酰亚胺
Property Insights of 二乙氨基-2-丁炔基琥珀酰亚胺
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二乙氨基-2-丁炔基琥珀酰亚胺. With a topological polar surface area (TPSA) of 49.4 Ų, 二乙氨基-2-丁炔基琥珀酰亚胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二乙氨基-2-丁炔基琥珀酰亚胺 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 二乙氨基-2-丁炔基琥珀酰亚胺?
The CAS number of 二乙氨基-2-丁炔基琥珀酰亚胺 is 7591-19-7.
What is the molecular formula of 二乙氨基-2-丁炔基琥珀酰亚胺?
The molecular formula of 二乙氨基-2-丁炔基琥珀酰亚胺 is C12H18N2O2.
What is the molecular weight of 二乙氨基-2-丁炔基琥珀酰亚胺?
The molecular weight of 二乙氨基-2-丁炔基琥珀酰亚胺 is 222.14 g/mol.
Where can I buy 二乙氨基-2-丁炔基琥珀酰亚胺?
You can request a quote for 二乙氨基-2-丁炔基琥珀酰亚胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二乙氨基-2-丁炔基琥珀酰亚胺?
Yes, KEHONG BIO provides custom synthesis services for 二乙氨基-2-丁炔基琥珀酰亚胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.