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98413-81-1

The chemical "2-((R)-5-Carboxymethyl-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-ylamino)-4-(1-methyl-cyclohexyl)-butyric acid ethyl ester; hydrochloride" is a complex organic compound with a molecular formula of C26H36N2O5S?HCl. It is a derivative of benzo[b][1,4]thiazepine, featuring a carboxylic acid group, an amino group, and a cyclohexyl ring. 2-((R)-5-Carboxymethyl-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-ylamino)-4-(1-methyl-cyclohexyl)-butyric acid ethyl ester; hydrochloride is known for its potential therapeutic applications, particularly as a modulator of certain receptors in the central nervous system. The hydrochloride salt form enhances its solubility and stability, which is often desirable for pharmaceutical applications. The specific stereochemistry at the R-configuration indicates that the molecule has a specific three-dimensional arrangement, which can significantly influence its biological activity.

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  • 2-((R)-5-Carboxymethyl-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-ylamino)-4-(1-methyl-cyclohexyl)-butyric acid ethyl ester; hydrochloride

    Cas No: 98413-81-1

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  • 98413-81-1 Structure

  • Basic information

    1. Product Name: 2-((R)-5-Carboxymethyl-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-ylamino)-4-(1-methyl-cyclohexyl)-butyric acid ethyl ester; hydrochloride
    2. Synonyms:
    3. CAS NO:98413-81-1
    4. Molecular Formula:
    5. Molecular Weight: 499.071
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 98413-81-1.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: N/A
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 2-((R)-5-Carboxymethyl-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-ylamino)-4-(1-methyl-cyclohexyl)-butyric acid ethyl ester; hydrochloride(CAS DataBase Reference)
    10. NIST Chemistry Reference: 2-((R)-5-Carboxymethyl-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-ylamino)-4-(1-methyl-cyclohexyl)-butyric acid ethyl ester; hydrochloride(98413-81-1)
    11. EPA Substance Registry System: 2-((R)-5-Carboxymethyl-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-ylamino)-4-(1-methyl-cyclohexyl)-butyric acid ethyl ester; hydrochloride(98413-81-1)

  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 98413-81-1(Hazardous Substances Data)

98413-81-1 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 98413-81-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,8,4,1 and 3 respectively; the second part has 2 digits, 8 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 98413-81:
(7*9)+(6*8)+(5*4)+(4*1)+(3*3)+(2*8)+(1*1)=161
161 % 10 = 1
So 98413-81-1 is a valid CAS Registry Number.

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