3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol
TL;DR: 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol (CAS 137056-72-5) is a chemical compound with molecular formula C32H56N2O2 and molecular weight 500.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[2-(dimethylamino)ethyl]carbamate
Also Known As: DC-Chol, DC Cholesterol, DC-Cholesterol, DC-Cholesterol HCl, DC-Chol (hydrochloride)
| Molecular Formula | C32H56N2O2 |
|---|---|
| Molecular Weight | 500.43 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 500.43417 |
| Heavy Atoms | 36 |
| Complexity | 791.0 |
Chemical Identifiers
| CAS Number | 137056-72-5 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)NCCN(C)C)C)C |
| InChIKey | HIHOWBSBBDRPDW-PTHRTHQKSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol (CAS 137056-72-5), with molecular formula C32H56N2O2 and molecular weight 500.43 g/mol. IUPAC: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[2-(dimethylamino)ethyl]carbamate.
Chemical Property Profile of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol
Property Insights of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol
The XLogP value of 9.0 indicates that 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol?
The CAS number of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol is 137056-72-5.
What is the molecular formula of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol?
The molecular formula of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol is C32H56N2O2.
What is the molecular weight of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol?
The molecular weight of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol is 500.43 g/mol.
Where can I buy 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol?
You can request a quote for 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol?
Yes, KEHONG BIO provides custom synthesis services for 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.