4-(2-chlorophenyl)-6-methyl-N-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide

HCID 2878457
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기본 정보

표준 SMILES
CC1=C(C(=O)Nc2ccccc2)C(c2ccccc2Cl)NC(=S)N1
InChIKey
ZVOWGPQFIBGWEZ-UHFFFAOYSA-N
분자식
C18H16ClN3OS
평균 분자량
357.9 g/mol

이름 및 식별자

우선 이름
4-(2-chlorophenyl)-6-methyl-N-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
IUPAC
4-(2-chlorophenyl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

이름 및 동의어

182170-94-14-(2-chlorophenyl)-6-methyl-N-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide4-(2-chlorophenyl)-6-methyl-N-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide6-(2-chlorophenyl)-4-methyl-N-phenyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamideCBMicro_049350STK092387AKOS000371784AKOS001623443AKOS016068309AKOS0220796074-(2-chlorophenyl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide6-(2-chlorophenyl)-4-methyl-N-phenyl-2-thioxo-1,2,3,6-tetrahydropyrimidine-5-carboxamide
이름 더 보기
BIM-0049543.P001EU-0037774SR-01000429497SR-01000429497-1F0459-0001

데이터베이스 식별자

PubChem CID
2878457

물성

구조 계산 물성

XLogP
3.2
극성 표면적
85.3 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
24

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