Tc 99m Pnao-sms
TL;DR: Tc 99m Pnao-sms (CAS 151956-25-1) is a chemical compound with molecular formula C70H96N15O13S3Tc and molecular weight 1549.5537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[[4-[[1-[[10-(4-aminobutyl)-16-benzyl-4-(1,3-dihydroxybutan-2-ylcarbamoyl)-7-(1-hydroxyethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicos-19-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamothioylamino]phenyl]methyl]-3-[(3E)-3-hydroxyimino-2-methylbutan-2-yl]azanidylpropyl]-[(3E)-2-methyl-3-oxidoiminobutan-2-yl]azanide;oxo(99Tc)technetium-99(3+)
Also Known As: Tc 99m Pnao-sms, Technetium Tc 99m 6-(4-thioureabenzyl)-3,3,9,9-tetramethyl-4,8-diazaundecane-phenylalanine(1)-octreotide
Technical Specifications
| Molecular Formula | C70H96N15O13S3Tc |
| Molecular Weight | 1549.5537 g/mol |
| XLogP | 4.3733 |
| Topological Polar Surface Area (TPSA) | 500.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 29 |
| Exact Mass | 1549.5537 Da |
| Heavy Atoms | 102 |
| Complexity | 2680.0 |
| SMILES | CC(C1C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)NC(=S)NC6=CC=C(C=C6)CC(C[N-]C(C)(C)/C(=N/O)/C)C[N-]C(C)(C)/C(=N/[O-])/C)C(=O)NC(CO)C(C)O)O.O=[99Tc+3] |
| InChIKey | GTMBGRSFXIOYDK-LKQYUXJMSA-M |
Chemical Property Profile of Tc 99m Pnao-sms
Property Insights of Tc 99m Pnao-sms
The XLogP value of 4.3733 indicates that Tc 99m Pnao-sms is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 500.0 Ų indicates high polarity, suggesting Tc 99m Pnao-sms may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tc 99m Pnao-sms has 15 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tc 99m Pnao-sms?
The CAS number of Tc 99m Pnao-sms is 151956-25-1.
What is the molecular formula of Tc 99m Pnao-sms?
The molecular formula of Tc 99m Pnao-sms is C70H96N15O13S3Tc.
What is the molecular weight of Tc 99m Pnao-sms?
The molecular weight of Tc 99m Pnao-sms is 1549.5537 g/mol.
Where can I buy Tc 99m Pnao-sms?
You can request a quote for Tc 99m Pnao-sms directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tc 99m Pnao-sms?
Yes, CoreyChem provides custom synthesis services for Tc 99m Pnao-sms and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.