BMS 187071
TL;DR: BMS 187071 (CAS 161302-39-2) is a chemical compound with molecular formula C32H49N3O6 and molecular weight 571.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-hydroxy-2,3,3-trimethylbutanoyl)amino]-4-phenylbutyl]amino]-1-phenylbutan-2-yl]carbamate
Also Known As: BMS 187071, Aminodiol t-hexanamide deriv., BMS 187,071, (3-((3-((2,3,3-Trimethyl-2(S)-2-hydroxy-1-oxobutyl)amino)-2-hydroxy-4-phenylbutyl)amino)-2-hydroxy-1-(phenylmethyl)propyl)carbamic acid, 1,1-dimethylethyl ester, tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-hydroxy-2,3,3-trimethylbutanoyl)amino]-4-phenylbutyl]amino]-1-phenylbutan-2-yl]carbamate
| Molecular Formula | C32H49N3O6 |
|---|---|
| Molecular Weight | 571.36 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 16 |
| Exact Mass | 571.3621 |
| Heavy Atoms | 41 |
| Complexity | 798.0 |
Chemical Identifiers
| CAS Number | 161302-39-2 |
|---|---|
| SMILES | CC(C)(C)C(C)(C(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CNC[C@H]([C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)O)O |
| InChIKey | QRYXFTOKZCERLS-IBUAGLKFSA-N |
Product Overview
BMS 187071 (CAS 161302-39-2), with molecular formula C32H49N3O6 and molecular weight 571.36 g/mol. IUPAC: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-hydroxy-2,3,3-trimethylbutanoyl)amino]-4-phenylbutyl]amino]-1-phenylbutan-2-yl]carbamate.
Chemical Property Profile of BMS 187071
Property Insights of BMS 187071
The XLogP value of 3.9 indicates that BMS 187071 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.0 Ų indicates high polarity, suggesting BMS 187071 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BMS 187071 has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BMS 187071?
The CAS number of BMS 187071 is 161302-39-2.
What is the molecular formula of BMS 187071?
The molecular formula of BMS 187071 is C32H49N3O6.
What is the molecular weight of BMS 187071?
The molecular weight of BMS 187071 is 571.36 g/mol.
Where can I buy BMS 187071?
You can request a quote for BMS 187071 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BMS 187071?
Yes, KEHONG BIO provides custom synthesis services for BMS 187071 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.