4-[(4-amino-2-methyl-5-pyrimidinylmethyl)(formyl)amino]-3-(2-hydroxyethyl)-2-thiapent-3-enyl benzoate

Modify Date: 2025-10-20 12:59:14

4-[(4-amino-2-methyl-5-pyrimidinylmethyl)(formyl)amino]-3-(2-hydroxyethyl)-2-thiapent-3-enyl benzoate structure	Common Name	4-[(4-amino-2-methyl-5-pyrimidinylmethyl)(formyl)amino]-3-(2-hydroxyethyl)-2-thiapent-3-enyl benzoate
	CAS Number	18481-26-0	Molecular Weight	416.49400
	Density	1.31g/cm3	Boiling Point	692.7ºC at 760mmHg
	Molecular Formula	C₂₀H₂₄N₄O₄S	Melting Point	N/A
	MSDS	N/A	Flash Point	372.7ºC

Name	[2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-hydroxypent-2-en-3-yl]sulfanylmethyl benzoate

Density	1.31g/cm3
Boiling Point	692.7ºC at 760mmHg
Molecular Formula	C₂₀H₂₄N₄O₄S
Molecular Weight	416.49400
Flash Point	372.7ºC
Exact Mass	416.15200
PSA	144.67000
LogP	3.05320
Vapour Pressure	3.84E-20mmHg at 25°C
Index of Refraction	1.631
InChIKey	KZZQSQPXTWSHLI-JXAWBTAJSA-N
SMILES	CC(=C(CCO)SCOC(=O)c1ccccc1)N(C=O)Cc1cnc(C)nc1N

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