N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic acid 1,5-diethyl ester 4-methylbenzenesulfonate
- CAS NO.：165049-28-5
- Empirical Formula: C31H37N5O9S
- Molecular Weight: 655.72
- MDL number: MFCD12911689
- EINECS: 605-383-3
- SAFETY DATA SHEET (SDS)
- Update Date: 2025-09-25 17:15:13
![N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic acid 1,5-diethyl ester 4-methylbenzenesulfonate Structural](https://img.chemicalbook.in/CAS/GIF/165049-28-5.gif)
What is N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic acid 1,5-diethyl ester 4-methylbenzenesulfonate?
Chemical properties
pink POWDER
The Uses of N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic acid 1,5-diethyl ester 4-methylbenzenesulfonate
N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic Acid, referred to as Pemetrexed, is used in the treatment of malignant pleural mesothelioma (MPM).
Properties of N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic acid 1,5-diethyl ester 4-methylbenzenesulfonate
| Melting point: | >237oC (dec.) |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | Dichloromethane (Very Slightly), DMF (Slightly, Sonicated), DMSO (Slightly) |
| form | Solid |
| color | Off-White to Pale Brown |
Safety information for N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic acid 1,5-diethyl ester 4-methylbenzenesulfonate
Computed Descriptors for N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic acid 1,5-diethyl ester 4-methylbenzenesulfonate
| InChIKey | UANBXQTVHOIGGQ-VOPAOICTNA-N |
| SMILES | S(C1C=CC(C)=CC=1)(O)(=O)=O.C(C1=CNC2N=C(N)NC(=O)C1=2)CC1C=CC(C(=O)N[C@H](C(=O)OCC)CCC(=O)OCC)=CC=1 |&1:31,r| |
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