BAS 00285101
TL;DR: BAS 00285101 (CAS 305864-86-2) is a chemical compound with molecular formula C16H17Cl3N6O7 and molecular weight 510.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methyl-5-nitroimidazol-1-yl)ethyl N-[2,2,2-trichloro-1-(4-methoxy-2-nitroanilino)ethyl]carbamate
Also Known As: BAS 00285101, 2-{5-nitro-2-methyl-1H-imidazol-1-yl}ethyl 2,2,2-trichloro-1-{2-nitro-4-methoxyanilino}ethylcarbamate, 2-(2-methyl-5-nitroimidazol-1-yl)ethyl N-[2,2,2-trichloro-1-(4-methoxy-2-nitroanilino)ethyl]carbamate, 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl (2,2,2-trichloro-1-((4-methoxy-2-nitrophenyl)amino)ethyl)carbamate, 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl {2,2,2-trichloro-1-[(4-methoxy-2-nitrophenyl)amino]ethyl}carbamate
| Molecular Formula | C16H17Cl3N6O7 |
|---|---|
| Molecular Weight | 510.02 g/mol |
| LogP | 3.55112 |
| Topological Polar Surface Area | 163.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 510.02243 |
| Heavy Atoms | 32 |
| Complexity | 1010.4938 |
Chemical Identifiers
| CAS Number | 305864-86-2 |
|---|---|
| SMILES | CC1=NC=C(N1CCOC(=O)NC(C(Cl)(Cl)Cl)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
BAS 00285101 (CAS 305864-86-2), with molecular formula C16H17Cl3N6O7 and molecular weight 510.02 g/mol. IUPAC: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl N-[2,2,2-trichloro-1-(4-methoxy-2-nitroanilino)ethyl]carbamate.
Chemical Property Profile of BAS 00285101
Property Insights of BAS 00285101
The XLogP value of 3.55112 indicates that BAS 00285101 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 163.69 Ų indicates high polarity, suggesting BAS 00285101 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00285101 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00285101?
The CAS number of BAS 00285101 is 305864-86-2.
What is the molecular formula of BAS 00285101?
The molecular formula of BAS 00285101 is C16H17Cl3N6O7.
What is the molecular weight of BAS 00285101?
The molecular weight of BAS 00285101 is 510.02 g/mol.
Where can I buy BAS 00285101?
You can request a quote for BAS 00285101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00285101?
Yes, KEHONG BIO provides custom synthesis services for BAS 00285101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.