Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-
TL;DR: Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)- (CAS 134963-34-1) is a chemical compound with molecular formula C17H21N3O4 and molecular weight 331.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5S)-4-(benzylamino)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: 3'-Benzylamino-dT, 3'-Benzylamino-3'-deoxythymidine, Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-, 3'-(Benzylamino)-3'-deoxythymidine, 3 -(Benzylamino)-3 -deoxythymidine
| Molecular Formula | C17H21N3O4 |
|---|---|
| Molecular Weight | 331.15 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.1532 |
| Heavy Atoms | 24 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 134963-34-1 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)NCC3=CC=CC=C3 |
| InChIKey | UIXPFAHXTKLMSQ-RRFJBIMHSA-N |
Product Overview
Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)- (CAS 134963-34-1), with molecular formula C17H21N3O4 and molecular weight 331.15 g/mol. IUPAC: 1-[(2R,4S,5S)-4-(benzylamino)-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione.
Chemical Property Profile of Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-
Property Insights of Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-. Following Lipinski's Rule of Five, Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)- has 3 hydrogen bond donor(s) and 5 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 Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-?
The CAS number of Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)- is 134963-34-1.
What is the molecular formula of Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-?
The molecular formula of Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)- is C17H21N3O4.
What is the molecular weight of Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-?
The molecular weight of Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)- is 331.15 g/mol.
Where can I buy Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-?
You can request a quote for Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Thymidine, 3'-deoxy-3'-((phenylmethyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.