Tmt-NSC
TL;DR: Tmt-NSC (CAS 157837-77-9) is a chemical compound with molecular formula C33H30N6O9S and molecular weight 686.1795 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[6-[6-[6-[[bis(carboxymethyl)amino]methyl]-2-pyridinyl]-4-(3-isothiocyanato-4-methoxyphenyl)-2-pyridinyl]-2-pyridinyl]methyl-(carboxymethyl)amino]acetic acid
Also Known As: Tmt-NSC, 2-[[6-[6-[6-[[bis(carboxymethyl)amino]methyl]pyridin-2-yl]-4-(3-isothiocyanato-4-methoxyphenyl)pyridin-2-yl]pyridin-2-yl]methyl-(carboxymethyl)amino]acetic acid, 4-(3-Isothiocyanate-4-methoxyphenyl)-6,6''-bis(N,N-di-(carboxymethylaminomethyl))-2,2'-6',2''-terpyridine, 2,2',2'',2'''-{[2~4~-(3-Isothiocyanato-4-methoxyphenyl)[1~2~,2~2~:2~6~,3~2~-terpyridine]-1~6~,3~6~-diyl]bis(methylenenitrilo)}tetraacetic acid, 4-(3-isothiocyanate-4-methoxyphenyl)-6,6/'/'-bis(N,N-di-(carboxymethylaminomethyl))-2,2/'-6/',2/'/'-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C33H30N6O9S |
| Molecular Weight | 686.1795 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 248.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 17 |
| Exact Mass | 686.1795 Da |
| Heavy Atoms | 49 |
| Complexity | 1090.0 |
| SMILES | COC1=C(C=C(C=C1)C2=CC(=NC(=C2)C3=CC=CC(=N3)CN(CC(=O)O)CC(=O)O)C4=CC=CC(=N4)CN(CC(=O)O)CC(=O)O)N=C=S |
| InChIKey | LLAAIHCOOOWFFP-UHFFFAOYSA-N |
Chemical Property Profile of Tmt-NSC
Property Insights of Tmt-NSC
The XLogP value of -1.3 indicates that Tmt-NSC is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 248.0 Ų indicates high polarity, suggesting Tmt-NSC may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tmt-NSC has 4 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tmt-NSC?
The CAS number of Tmt-NSC is 157837-77-9.
What is the molecular formula of Tmt-NSC?
The molecular formula of Tmt-NSC is C33H30N6O9S.
What is the molecular weight of Tmt-NSC?
The molecular weight of Tmt-NSC is 686.1795 g/mol.
Where can I buy Tmt-NSC?
You can request a quote for Tmt-NSC directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tmt-NSC?
Yes, CoreyChem provides custom synthesis services for Tmt-NSC and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.