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Chemical structure of (S)-Diethyl 2-(4-(2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl)benzamido)pentanedioate 4-methylbenzenesulfonate

GB52072

(S)-Diethyl 2-(4-(2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl)benzamido)pentanedioate 4-methylbenzenesulfonate

Also known as diethyl (2S)-2-[[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-1-ium-5-yl)ethyl]benzoyl]amino]pentanedioate;4-methylbenzenesulfonate

(S)-Diethyl 2-(4-(2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl)benzamido)pentanedioate 4-methylbenzenesulfonate (catalogue number GB52072) is a research-grade chemical available from LABO Scientific in Israel, CAS registry number 165049-28-5. Molecular formula C31H37N5O9S, molecular weight 655.72. IUPAC name: diethyl (2S)-2-[[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-1-ium-5-yl)ethyl]benzoyl]amino]pentanedioate;4-methylbenzenesulfonate. Supplied in 3 pack sizes, from 5g at ₪130.53 to 25g at ₪562.89; the final price is confirmed on your quote, and the lot certificate of analysis and safety data sheet are emailed with your order confirmation.

ChemicalCAS165049-28-5MW655.72FormulaC31H37N5O9S
CAS number
165049-28-5
Molecular weight
655.72
Formula
C31H37N5O9S
InChIKey
UANBXQTVHOIGGQ-LMOVPXPDSA-N
Catalogue number
GB52072
Brand
GLPBIO
Computed properties PubChem CID 135546309 · TPSA 232 Ų · H-bond donors 5 · H-bond acceptors 9
TPSA
232 Ų
H-bond donors
5
H-bond acceptors
9
Rotatable bonds
13
Heavy atoms
46

SMILES CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)CCC2=CNC3=C2C(=O)NC(=[NH+]3)N.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Computed descriptors from PubChem (CID 135546309), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
Ships from the manufacturer to your lab in 8–14 business days; customs and cold chain handled by LABO Scientific.
Pricing
Quoted in ILS, excl. VAT. Add the item to your quote and we confirm the final price, usually the same business day.
Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
Who we serve
Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.