Name: Name:1H-Indole-3-carboxylic acid, 1-cyclohexyl-5-hydroxy-2-methyl-, ethyl ester
Brand: Angene
SKU: AG0005KR
Rating: 90 (10 reviews)

1H-Indole-3-carboxylic acid, 1-cyclohexyl-5-hydroxy-2-methyl-, ethyl ester

CAS No.:

101782-20-1

Catalog Number:

AG0005KR

Molecular Formula:

C18H23NO3

Molecular Weight:

301.3801

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG0005KR

Chemical Name:

1H-Indole-3-carboxylic acid, 1-cyclohexyl-5-hydroxy-2-methyl-, ethyl ester

CAS Number:

101782-20-1

Molecular Formula:

C18H23NO3

Molecular Weight:

301.3801

MDL Number:

MFCD00408072

IUPAC Name:

ethyl 1-cyclohexyl-5-hydroxy-2-methylindole-3-carboxylate

InChI:

InChI=1S/C18H23NO3/c1-3-22-18(21)17-12(2)19(13-7-5-4-6-8-13)16-10-9-14(20)11-15(16)17/h9-11,13,20H,3-8H2,1-2H3

InChI Key:

CXEMQLWMAUFGHN-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1c(C)n(c2c1cc(O)cc2)C1CCCCC1

Properties

Complexity:

394

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

301.168g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.386g/mol

Monoisotopic Mass:

301.168g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101

Properties