AB-MECA
TL;DR: AB-MECA (CAS 152918-26-8) is a chemical compound with molecular formula C18H21N7O4 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
AB-MECA
5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide
Also Known As: AB-MECA, 5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide, (2S,3S,4R,5R)-5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide
| Molecular Formula | C18H21N7O4 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.1655 |
| Heavy Atoms | 29 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 152918-26-8 |
|---|---|
| SMILES | CNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)NCC4=CC=C(C=C4)N)O)O |
| InChIKey | LDYMCRRFCMRFKB-UHFFFAOYSA-N |
Product Overview
AB-MECA (CAS 152918-26-8), with molecular formula C18H21N7O4 and molecular weight 399.17 g/mol. IUPAC: 5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide.
Chemical Property Profile of AB-MECA
Property Insights of AB-MECA
The XLogP value of -0.4 indicates that AB-MECA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting AB-MECA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CID 1970 has 5 hydrogen bond donor(s) and 9 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 CID 1970?
The CAS number of CID 1970 is 152918-26-8.
What is the molecular formula of CID 1970?
The molecular formula of CID 1970 is C18H21N7O4.
What is the molecular weight of CID 1970?
The molecular weight of CID 1970 is 399.17 g/mol.
Where can I buy CID 1970?
You can request a quote for CID 1970 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 1970?
Yes, KEHONG BIO provides custom synthesis services for CID 1970 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.