Text Search
Structure Search

4-{[(3,5-dimethylphenyl)carbamoyl]amino}phenyl sulfamate

4-{[(3,5-dimethylphenyl)carbamoyl]amino}phenyl sulfamate

Formula: C15H17N3O4S

SMILES: CC1=CC(NC(=O)NC2=CC=C(OS(N)(=O)=O)C=C2)=CC(C)=C1

IUPAC: 4-{[(3,5-dimethylphenyl)carbamoyl]amino}phenyl sulfamate

InChI: InChI=1S/C15H17N3O4S/c1-10-7-11(2)9-13(8-10)18-15(19)17-12-3-5-14(6-4-12)22-23(16,20)21/h3-9H,1-2H3,(H2,16,20,21)(H2,17,18,19)

Composition: C (53.72%), H (5.11%), N (12.53%), O (19.08%), S (9.56%)

Molar Mass: 335.38

Atom Count: 40

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 335.093977213
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey HGVHSNXRZYOTPD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.64
Topological Polar Surface Area 110.52
Polarizability 33.64
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C15H17N3O4S Quote Only