N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine

C19H13N5S2 — CID 177371837

IUPACN-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine
SMILESCc1csc(-c2ccc3ncnc(Nc4ccc5scnc5c4)c3c2)n1
InChIInChI=1S/C19H13N5S2/c1-11-8-25-19(23-11)12-2-4-15-14(6-12)18(21-9-20-15)24-13-3-5-17-16(7-13)22-10-26-17/h2-10H,1H3,(H,20,21,24)
InChIKeyMEWQFVCNRWMTNX-UHFFFAOYSA-N
MW375.48 g/mol
LogP5.42
Rot. Bonds3

About N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine

N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine (PubChem CID 177371837) has the molecular formula C19H13N5S2 and a molecular weight of 375.48 g/mol. Its IUPAC name is N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine.

Molecular Properties

Compound NameN-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine
PubChem CID177371837
Molecular FormulaC19H13N5S2
Molecular Weight375.48 g/mol
Exact Mass375.06
IUPAC NameN-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine
SMILESCc1csc(-c2ccc3ncnc(Nc4ccc5scnc5c4)c3c2)n1
InChIInChI=1S/C19H13N5S2/c1-11-8-25-19(23-11)12-2-4-15-14(6-12)18(21-9-20-15)24-13-3-5-17-16(7-13)22-10-26-17/h2-10H,1H3,(H,20,21,24)
InChIKeyMEWQFVCNRWMTNX-UHFFFAOYSA-N
XLogP5.42
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.48
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine with MolForge

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Related Compounds

ethane;N-(7-methoxy-6-methylquinazolin-4-yl)-1,3-benzothiazol-5-amine
CID 144534778
N-(6-dimethylphosphoryl-7-methoxyquinazolin-4-yl)-1,3-benzothiazol-5-amine
CID 146437991
N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736897
N-[7-chloro-6-(6-methoxy-2-pyridinyl)quinazolin-4-yl]-1,3-benzothiazol-5-amine
CID 177371830
4-N-(1,3-benzothiazol-6-yl)-7-methoxyquinazoline-4,6-diamine
CID 171088906
6-methyl-N-(4-methylphenyl)quinazolin-4-amine
CID 5328827
N-[4-(1,3-benzothiazol-5-yloxy)-3-methylphenyl]-6-(2-methoxyethoxy)quinazolin-4-amine;hydrochloride
CID 66937017
N-(7-bromo-6-chloroquinazolin-4-yl)-1,3-benzothiazol-6-amine
CID 171089475
(E)-3-[4-(1,3-benzothiazol-5-ylamino)-6-tert-butylsulfonylquinazolin-7-yl]prop-2-en-1-ol;N-(6-tert-butylsulfonyl-7-methylquinazolin-4-yl)-1,3-benzothiazol-5-amine
CID 160864779
N-(1,3-benzothiazol-5-yl)-6-thiophen-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 177378488
N-[6-tert-butylsulfonyl-7-(2-chloroethoxy)quinazolin-4-yl]-1,3-benzothiazol-5-amine
CID 89410811
N-[6-bis(prop-2-enyl)phosphoryl-7-methoxyquinazolin-4-yl]-1,3-benzothiazol-5-amine
CID 146438260

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine?
The IUPAC name of N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine (CID 177371837) is N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine.
What is the SMILES notation for N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine?
The canonical SMILES for N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine is Cc1csc(-c2ccc3ncnc(Nc4ccc5scnc5c4)c3c2)n1.
What is the InChIKey of N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine?
The InChIKey is MEWQFVCNRWMTNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N5S2/c1-11-8-25-19(23-11)12-2-4-15-14(6-12)18(21-9-20-15)24-13-3-5-17-16(7-13)22-10-26-17/h2-10H,1H3,(H,20,21,24).
What are the key properties of N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine?
N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine has a molecular weight of 375.48 g/mol, XLogP of 5.42, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine is sourced from PubChem (CID 177371837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).