BRD-A45027812-001-04-7
TL;DR: BRD-A45027812-001-04-7 (CAS 492426-33-2) is a chemical compound with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(dimethylamino)phenyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-1-(2-phenylethyl)thiourea
Also Known As: BRD-A45027812-001-04-7, 3-[4-(dimethylamino)phenyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-1-(2-phenylethyl)thiourea, N'-[4-(dimethylamino)phenyl]-N-[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-N-(2-phenylethyl)thiourea, 3-(4-dimethylaminophenyl)-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-1-phenethylthiourea, N'-[4-(DIMETHYLAMINO)PHENYL]-N-[1-(4-METHYLPHENYL)-2,5-DIOXOTETRAHYDRO-1H-PYRROL-3-YL]-N-PHENETHYLTHIOUREA
| Molecular Formula | C28H30N4O2S |
|---|---|
| Molecular Weight | 486.21 g/mol |
| LogP | 4.63462 |
| Topological Polar Surface Area | 55.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.20895 |
| Heavy Atoms | 35 |
| Complexity | 1193.8916 |
Chemical Identifiers
| CAS Number | 492426-33-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=S)NC4=CC=C(C=C4)N(C)C |
Product Overview
BRD-A45027812-001-04-7 (CAS 492426-33-2), with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol. IUPAC: 3-[4-(dimethylamino)phenyl]-1-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-1-(2-phenylethyl)thiourea.
Chemical Property Profile of BRD-A45027812-001-04-7
Property Insights of BRD-A45027812-001-04-7
The XLogP value of 4.63462 indicates that BRD-A45027812-001-04-7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.89 Ų, BRD-A45027812-001-04-7 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BRD-A45027812-001-04-7 has 1 hydrogen bond donor(s) and 4 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 BRD-A45027812-001-04-7?
The CAS number of BRD-A45027812-001-04-7 is 492426-33-2.
What is the molecular formula of BRD-A45027812-001-04-7?
The molecular formula of BRD-A45027812-001-04-7 is C28H30N4O2S.
What is the molecular weight of BRD-A45027812-001-04-7?
The molecular weight of BRD-A45027812-001-04-7 is 486.21 g/mol.
Where can I buy BRD-A45027812-001-04-7?
You can request a quote for BRD-A45027812-001-04-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-A45027812-001-04-7?
Yes, KEHONG BIO provides custom synthesis services for BRD-A45027812-001-04-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.