Home Carbonyls 4-(5-([(4-Methoxyphenyl)amino]carbonyl)-1,3,4-thiadiazol-2-yl)butanoic acid

4-(5-([(4-Methoxyphenyl)amino]carbonyl)-1,3,4-thiadiazol-2-yl)butanoic acid

CAS No.:
1142210-57-8
Catalog Number:
AG00HCU9
Molecular Formula:
C14H15N3O4S
Molecular Weight:
321.3516
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$150
- +
1g
95%
In Stock USA
United States
$338
- +
5g
95%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG00HCU9
Chemical Name:
4-(5-([(4-Methoxyphenyl)amino]carbonyl)-1,3,4-thiadiazol-2-yl)butanoic acid
CAS Number:
1142210-57-8
Molecular Formula:
C14H15N3O4S
Molecular Weight:
321.3516
MDL Number:
MFCD12028350
IUPAC Name:
4-[5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]butanoic acid
InChI:
InChI=1S/C14H15N3O4S/c1-21-10-7-5-9(6-8-10)15-13(20)14-17-16-11(22-14)3-2-4-12(18)19/h5-8H,2-4H2,1H3,(H,15,20)(H,18,19)
InChI Key:
YMBMMPBSKQTCEZ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=O)c1nnc(s1)CCCC(=O)O
Properties
Complexity:
388  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.078g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
321.351g/mol
Monoisotopic Mass:
321.078g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties