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

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

 EINECS N/A
CAS No. 146943-43-3 Density 1.38
PSA 169.26000 LogP 2.59550
Solubility N/A Melting Point 84-86 °C
Formula C24H29 N5 O6 Boiling Point N/A
Molecular Weight 483.524 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 146943-43-3 (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) Hazard Symbols N/A
Synonyms

L-Glutamicacid, N-[4-[2-(2-amino-4,7-dihydro-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-,diethyl ester (9CI); 1H-Pyrrolo[2,3-d]pyrimidine, L-glutamic acid deriv.

Article Data 15

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

Molecular 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 (CAS NO.146943-43-3):

Molecular Formula: C24H29N5O6
Molecular Weight: 483.52
Systematic Name: Diethyl N-({4-[2-(2-amino-4-hydroxy-7H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]phenyl}carbonyl)glutamate 
SMILES: CCOC(=O)C(CCC(=O)OCC)NC(=O)c1ccc(cc1)CCc3cnc2nc(N)nc(O)c23 
InChI: InChI=1/C24H29N5O6/c1-3-34-18(30)12-11-17(23(33)35-4-2)27-21(31)15-8-5-14(6-9-15)7-10-16-13-26-20-19(16)22(32)29-24(25)28-20/h5-6,8-9,13,17H,3-4,7,10-12H2,1-2H3,(H,27,31)(H4,25,26,28,29,32) 
InChIKey: DEJAOZLLEHXUBF-UHFFFAOYAQ
Synonyms of (S)-Diethyl 2-(4-(2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl)benzamido)pentanedioate (CAS NO.146943-43-3): 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
CAS NO: 146943-43-3
Melting point: 84-86 °C 
Index of Refraction: 1.63
Molar Refractivity: 129.05 cm3
Molar Volume: 362.2 cm3
Surface Tension: 64.5 dyne/cm
Density: 1.334 g/cm3

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