BAS 10113353
TL;DR: BAS 10113353 (CAS 2580100-88-3) is a chemical compound with molecular formula C12H17N3O4 and molecular weight 267.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R)-5-[(2-methylpropan-2-yl)oxycarbonyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxylic acid
Also Known As: BAS 10113353, (6R)-5-[(tert-butoxy)carbonyl]-1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-6-carboxylic acid, (6R)-5-[(2-methylpropan-2-yl)oxycarbonyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxylic acid
| Molecular Formula | C12H17N3O4 |
|---|---|
| Molecular Weight | 267.12 g/mol |
| LogP | 1.1561 |
| Topological Polar Surface Area | 95.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 267.12192 |
| Heavy Atoms | 19 |
| Complexity | 503.31793 |
Chemical Identifiers
| CAS Number | 2580100-88-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CC2=C(C[C@@H]1C(=O)O)N=CN2 |
Product Overview
BAS 10113353 (CAS 2580100-88-3), with molecular formula C12H17N3O4 and molecular weight 267.12 g/mol. IUPAC: (6R)-5-[(2-methylpropan-2-yl)oxycarbonyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxylic acid.
Chemical Property Profile of BAS 10113353
Property Insights of BAS 10113353
The XLogP value of 1.1561 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 10113353. The TPSA of 95.52 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10113353. Following Lipinski's Rule of Five, BAS 10113353 has 2 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 BAS 10113353?
The CAS number of BAS 10113353 is 2580100-88-3.
What is the molecular formula of BAS 10113353?
The molecular formula of BAS 10113353 is C12H17N3O4.
What is the molecular weight of BAS 10113353?
The molecular weight of BAS 10113353 is 267.12 g/mol.
Where can I buy BAS 10113353?
You can request a quote for BAS 10113353 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10113353?
Yes, KEHONG BIO provides custom synthesis services for BAS 10113353 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.