Tan 1057B
TL;DR: Tan 1057B (CAS 128126-44-3) is a chemical compound with molecular formula C13H25N9O3 and molecular weight 355.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-N-[(5R)-2-(carbamoylamino)-6-oxo-4,5-dihydro-1H-pyrimidin-5-yl]-6-(diaminomethylideneamino)-N-methylhexanamide
Also Known As: Tan 1057B, TAN-1057B, Antibiotic TAN 1057A, Antibiotic TAN 1057B, TAN-1057A
| Molecular Formula | C13H25N9O3 |
|---|---|
| Molecular Weight | 355.21 g/mol |
| LogP | -4.2 |
| Topological Polar Surface Area | 207.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 355.20804 |
| Heavy Atoms | 25 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 128126-44-3 |
|---|---|
| SMILES | CN([C@@H]1CN=C(NC1=O)NC(=O)N)C(=O)C[C@H](CCCN=C(N)N)N |
| InChIKey | ZMWBCGMRXBPXEU-JGVFFNPUSA-N |
Product Overview
Tan 1057B (CAS 128126-44-3), with molecular formula C13H25N9O3 and molecular weight 355.21 g/mol. IUPAC: (3S)-3-amino-N-[(5R)-2-(carbamoylamino)-6-oxo-4,5-dihydro-1H-pyrimidin-5-yl]-6-(diaminomethylideneamino)-N-methylhexanamide.
Chemical Property Profile of Tan 1057B
Property Insights of Tan 1057B
The XLogP value of -4.2 indicates that Tan 1057B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 207.0 Ų indicates high polarity, suggesting Tan 1057B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tan 1057B has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tan 1057B?
The CAS number of Tan 1057B is 128126-44-3.
What is the molecular formula of Tan 1057B?
The molecular formula of Tan 1057B is C13H25N9O3.
What is the molecular weight of Tan 1057B?
The molecular weight of Tan 1057B is 355.21 g/mol.
Where can I buy Tan 1057B?
You can request a quote for Tan 1057B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tan 1057B?
Yes, KEHONG BIO provides custom synthesis services for Tan 1057B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.