T 1187
TL;DR: T 1187 (CAS 59723-60-3) is a chemical compound with molecular formula C22H25N5O7S and molecular weight 503.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R,6R)-3,3-dimethyl-6-[[2-[(4-methyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: T 1187, 6-(D-(-)-alpha-(4-Methyl-2,3-dioxo-1-piperazinecarboxamido)phenylacetamido)penicillanic acid, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-6-(((((4-methyl-2,3-dioxo-1-piperazinyl)carbonyl)amino)phenylacetyl)amino)-7-oxo-, (2S-(2-alpha,5-alpha,6-beta(S*)))-, (2S,5R,6R)-3,3-dimethyl-6-[[2-[(4-methyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-phenyl-acetyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, (2S,5R,6R)-3,3-dimethyl-6-[[2-[(4-methyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
| Molecular Formula | C22H25N5O7S |
|---|---|
| Molecular Weight | 503.15 g/mol |
| LogP | -0.6304 |
| Topological Polar Surface Area | 156.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 503.14746 |
| Heavy Atoms | 35 |
| Complexity | 1110.6716 |
Chemical Identifiers
| CAS Number | 59723-60-3 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)NC(=O)N4CCN(C(=O)C4=O)C)C(=O)O)C |
Product Overview
T 1187 (CAS 59723-60-3), with molecular formula C22H25N5O7S and molecular weight 503.15 g/mol. IUPAC: (2S,5R,6R)-3,3-dimethyl-6-[[2-[(4-methyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of T 1187
Property Insights of T 1187
The XLogP value of -0.6304 indicates that T 1187 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 156.43 Ų indicates high polarity, suggesting T 1187 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, T 1187 has 3 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 T 1187?
The CAS number of T 1187 is 59723-60-3.
What is the molecular formula of T 1187?
The molecular formula of T 1187 is C22H25N5O7S.
What is the molecular weight of T 1187?
The molecular weight of T 1187 is 503.15 g/mol.
Where can I buy T 1187?
You can request a quote for T 1187 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for T 1187?
Yes, KEHONG BIO provides custom synthesis services for T 1187 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.