BC 197
TL;DR: BC 197 (CAS 115295-08-4) is a chemical compound with molecular formula C60H81N11O17S and molecular weight 1259.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexa-3,5-dienyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-oxo-4-sulfooxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoic acid
Also Known As: BC 197
| Molecular Formula | C60H81N11O17S |
|---|---|
| Molecular Weight | 1259.55 g/mol |
| LogP | 1.4192 |
| Topological Polar Surface Area | 448.06 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 36 |
| Exact Mass | 1259.5532 |
| Heavy Atoms | 89 |
| Complexity | 3226.0332 |
Chemical Identifiers
| CAS Number | 115295-08-4 |
|---|---|
| SMILES | CCCC[C@@H](C(=O)N[C@@H](CC(=O)OS(=O)(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(=O)[C@@H](CC(=O)O)NC(=O)OC(C)(C)C)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@@H](CCCCN)NC[C@H](C=CC=C)NC(=O)[C@H](CC4=CC=C(C=C4)O)N |
Product Overview
BC 197 (CAS 115295-08-4), with molecular formula C60H81N11O17S and molecular weight 1259.55 g/mol. IUPAC: (3R)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexa-3,5-dienyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-oxo-4-sulfooxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoic acid.
Chemical Property Profile of BC 197
Property Insights of BC 197
The XLogP value of 1.4192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BC 197. The TPSA of 448.06 Ų indicates high polarity, suggesting BC 197 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BC 197 has 14 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BC 197?
The CAS number of BC 197 is 115295-08-4.
What is the molecular formula of BC 197?
The molecular formula of BC 197 is C60H81N11O17S.
What is the molecular weight of BC 197?
The molecular weight of BC 197 is 1259.55 g/mol.
Where can I buy BC 197?
You can request a quote for BC 197 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BC 197?
Yes, KEHONG BIO provides custom synthesis services for BC 197 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.