methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate

C10H17N3O4S2 — CID 43624505

IUPACmethyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate
SMILESCCN(CC)S(=O)(=O)Nc1nc(CC(=O)OC)cs1
InChIInChI=1S/C10H17N3O4S2/c1-4-13(5-2)19(15,16)12-10-11-8(7-18-10)6-9(14)17-3/h7H,4-6H2,1-3H3,(H,11,12)
InChIKeyUZLUHOYHORMJGH-UHFFFAOYSA-N
MW307.40 g/mol
LogP0.86
Rot. Bonds7

About methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate

methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate (PubChem CID 43624505) has the molecular formula C10H17N3O4S2 and a molecular weight of 307.40 g/mol. Its IUPAC name is methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate
PubChem CID43624505
Molecular FormulaC10H17N3O4S2
Molecular Weight307.40 g/mol
Exact Mass307.07
IUPAC Namemethyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate
SMILESCCN(CC)S(=O)(=O)Nc1nc(CC(=O)OC)cs1
InChIInChI=1S/C10H17N3O4S2/c1-4-13(5-2)19(15,16)12-10-11-8(7-18-10)6-9(14)17-3/h7H,4-6H2,1-3H3,(H,11,12)
InChIKeyUZLUHOYHORMJGH-UHFFFAOYSA-N
XLogP0.86
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[2-(methoxycarbonylsulfamoylamino)-1,3-thiazol-4-yl]acetate
CID 114465423
2-[2-(dipropylsulfamoylamino)-1,3-thiazol-4-yl]acetic acid
CID 43361116
methyl 2-[2-(2-methoxyethylsulfonylamino)-1,3-thiazol-4-yl]acetate
CID 55014446
methyl 2-[2-(thiophen-2-ylsulfonylamino)-1,3-thiazol-4-yl]acetate
CID 43624509
methyl 2-[2-[(4-methylphenyl)sulfonylamino]-1,3-thiazol-4-yl]acetate
CID 43624510
methyl 2-[2-(benzylsulfonylamino)-1,3-thiazol-4-yl]acetate
CID 43624515
methyl 2-[2-(azepan-1-ylsulfonylamino)-1,3-thiazol-4-yl]acetate
CID 43624502
methyl 2-[2-[(2-methylsulfonylacetyl)amino]-1,3-thiazol-4-yl]acetate
CID 61354731
sodium N-[4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2-yl]sulfamate
CID 174221224
methyl 2-[2-[(3-bromophenyl)sulfonylamino]-1,3-thiazol-4-yl]acetate
CID 43624485
methyl 2-[2-(2-methylpentan-3-ylamino)-1,3-thiazol-4-yl]acetate
CID 80575087
ethyl 2-[2-(difluoromethylsulfonylamino)-1,3-thiazol-4-yl]acetate
CID 43624476

Frequently Asked Questions

What is the IUPAC name of methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate?
The IUPAC name of methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate (CID 43624505) is methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate.
What is the SMILES notation for methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate?
The canonical SMILES for methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate is CCN(CC)S(=O)(=O)Nc1nc(CC(=O)OC)cs1.
What is the InChIKey of methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate?
The InChIKey is UZLUHOYHORMJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O4S2/c1-4-13(5-2)19(15,16)12-10-11-8(7-18-10)6-9(14)17-3/h7H,4-6H2,1-3H3,(H,11,12).
What are the key properties of methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate?
methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate has a molecular weight of 307.40 g/mol, XLogP of 0.86, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[2-(diethylsulfamoylamino)-1,3-thiazol-4-yl]acetate is sourced from PubChem (CID 43624505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).