RefChem:387819
TL;DR: RefChem:387819 (CAS 145131-61-9) is a chemical compound with molecular formula C29H39N3O and molecular weight 445.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[1-(1,3-dimethylindol-2-yl)cyclopentyl]methyl]-3-[2,6-di(propan-2-yl)phenyl]urea
Also Known As: Urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-((1-(1,3-dimethyl-1H-indol-2-yl)cyclopentyl)methyl)-, N(sup 1)-(2,6-Diisopropylphenyl)-N(sup 2)-(1-(1,3-dimethyl-2-indolyl)cyclopentylmethyl)urea, N-(2,6-Bis(1-methylethyl)phenyl)-N'-((1-(1,3-dimethyl-1H-indol-2-yl)cyclopentyl)methyl)urea, 1-[[1-(1,3-dimethylindol-2-yl)cyclopentyl]methyl]-3-[2,6-di(propan-2-yl)phenyl]urea, 1-[2,6-bis(propan-2-yl)phenyl]-3-{[1-(1,3-dimethyl-1H-indol-2-yl)cyclopentyl]methyl}urea
| Molecular Formula | C29H39N3O |
|---|---|
| Molecular Weight | 445.31 g/mol |
| LogP | 7.36702 |
| Topological Polar Surface Area | 46.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.30933 |
| Heavy Atoms | 33 |
| Complexity | 1083.8785 |
Chemical Identifiers
| CAS Number | 145131-61-9 |
|---|---|
| SMILES | CC1=C(N(C2=CC=CC=C12)C)C3(CCCC3)CNC(=O)NC4=C(C=CC=C4C(C)C)C(C)C |
Product Overview
RefChem:387819 (CAS 145131-61-9), with molecular formula C29H39N3O and molecular weight 445.31 g/mol. IUPAC: 1-[[1-(1,3-dimethylindol-2-yl)cyclopentyl]methyl]-3-[2,6-di(propan-2-yl)phenyl]urea.
Chemical Property Profile of RefChem:387819
Property Insights of RefChem:387819
The XLogP value of 7.36702 indicates that RefChem:387819 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.06 Ų, RefChem:387819 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:387819 has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:387819?
The CAS number of RefChem:387819 is 145131-61-9.
What is the molecular formula of RefChem:387819?
The molecular formula of RefChem:387819 is C29H39N3O.
What is the molecular weight of RefChem:387819?
The molecular weight of RefChem:387819 is 445.31 g/mol.
Where can I buy RefChem:387819?
You can request a quote for RefChem:387819 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:387819?
Yes, KEHONG BIO provides custom synthesis services for RefChem:387819 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.